data_2mqd_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 2mqd _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 23' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 . . . . . 0 CA--C 1.543 0.684 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 p -131.22 152.39 50.55 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.182 1.393 . . . . 0.0 107.29 168.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -59.33 -42.89 92.53 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 124.357 1.063 . . . . 0.0 109.769 -173.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -45.12 -47.64 12.12 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.019 1.728 . . . . 0.0 111.998 172.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -73.84 -28.71 61.74 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.685 1.194 . . . . 0.0 111.846 -174.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 71.4 mt -83.15 -34.12 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 125.018 1.327 . . . . 0.0 110.11 -176.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.59 -36.78 93.7 Favored Glycine 0 C--N 1.336 0.538 0 CA-C-N 118.997 0.817 . . . . 0.0 112.157 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.7 t -56.81 -47.8 82.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 CA-C-N 117.474 0.637 . . . . 0.0 109.972 175.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 mp -60.02 -46.77 88.39 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.688 0.676 . . . . 0.0 109.27 177.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.7 -25.5 68.23 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.89 -24.31 10.77 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 119.059 0.845 . . . . 0.0 112.225 176.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mp -62.68 -28.14 69.73 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.067 1.933 . . . . 0.0 110.391 165.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.59 -24.0 61.03 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.094 1.358 . . . . 0.0 113.289 172.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.7 mm -142.38 93.12 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 125.255 1.422 . . . . 0.0 107.428 -166.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.83 65.49 1.0 Allowed Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 125.783 1.633 . . . . 0.0 111.282 -176.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -60.98 -33.28 92.54 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.3 2.667 . . . . 0.0 111.643 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -71.25 -40.86 70.75 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.582 0.753 . . . . 0.0 109.343 -176.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -64.54 -37.52 87.84 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 121.985 -0.447 . . . . 0.0 111.22 173.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.78 -49.86 76.06 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 120.998 -1.064 . . . . 0.0 108.682 173.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -59.62 -48.04 83.22 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 116.879 -1.534 . . . . 0.0 113.161 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.63 -38.95 75.86 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.167 1.349 . . . . 0.0 111.157 -176.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -75.64 -48.5 21.87 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.65 1.18 . . . . 0.0 110.732 -176.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.3 mm -59.62 -32.03 48.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 119.419 1.009 . . . . 0.0 111.151 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.7 -39.04 70.48 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.458 1.026 . . . . 0.0 111.329 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -110.11 19.81 18.56 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.851 1.26 . . . . 0.0 111.758 176.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.78 14.54 3.27 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 120.247 -1.533 . . . . 0.0 113.808 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -69.94 -6.61 34.22 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.529 1.932 . . . . 0.0 113.422 -171.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.3 tp -86.01 131.01 34.37 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.086 1.354 . . . . 0.0 108.275 -172.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 98.8 t -106.44 131.07 57.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 171.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -94.09 116.36 28.77 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 161.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -144.3 164.06 27.7 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 171.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 22.8 mm -101.62 140.99 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -177.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.1 t -51.7 -73.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 125.876 1.67 . . . . 0.0 110.927 175.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? 56.62 166.01 0.06 OUTLIER Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 125.728 1.611 . . . . 0.0 112.84 -168.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -70.34 75.85 1.42 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 121.746 1.631 . . . . 0.0 109.061 160.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.1 t -130.51 -56.02 1.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.053 1.341 . . . . 0.0 110.986 -167.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -130.46 176.14 8.39 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.194 0.998 . . . . 0.0 108.625 -171.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.5 m -57.92 113.95 2.11 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.594 0.758 . . . . 0.0 109.814 171.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 6.1 m -137.98 159.34 68.89 Favored Pre-proline 0 C--O 1.239 0.521 0 O-C-N 121.965 -0.459 . . . . 0.0 110.236 174.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -72.26 175.64 9.68 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 123.578 2.852 . . . . 0.0 111.475 169.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.26 152.19 43.53 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 123.867 0.867 . . . . 0.0 111.34 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.65 28.93 33.87 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.856 -0.969 . . . . 0.0 114.483 162.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.0 m -140.52 28.68 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 124.405 1.082 . . . . 0.0 111.203 -174.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -64.0 -16.16 60.99 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 -153.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -151.51 29.14 0.62 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 127.609 2.363 . . . . 0.0 108.496 173.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -71.46 148.31 46.97 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 172.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.415 ' HB2' ' CE1' ' A' ' 84' ' ' PHE . 0.0 OUTLIER -77.97 142.49 38.29 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 166.01 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -128.06 135.31 49.66 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.874 0.87 . . . . 0.0 109.412 170.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.23 131.39 46.2 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 172.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.5 p -151.39 166.66 1.95 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.01 156.26 16.39 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 165.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.41 -16.14 53.21 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -113.21 -2.01 14.2 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.77 1.228 . . . . 0.0 111.978 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -110.43 22.77 15.09 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.373 1.069 . . . . 0.0 110.08 -170.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -44.88 -63.95 0.81 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.267 1.027 . . . . 0.0 111.154 -174.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -82.75 -16.65 47.16 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.796 0.438 . . . . 0.0 110.196 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -54.76 -80.22 0.08 OUTLIER Glycine 0 CA--C 1.527 0.81 0 C-N-CA 127.994 2.711 . . . . 0.0 113.82 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -148.45 148.78 30.66 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.208 1.004 . . . . 0.0 108.683 -176.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.7 tt -150.67 148.49 15.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-N 119.175 0.898 . . . . 0.0 109.225 -177.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 50.1 mt -134.85 110.01 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 N-CA-C 107.823 -1.176 . . . . 0.0 107.823 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -85.83 146.62 26.67 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 169.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.415 ' CE1' ' HB2' ' A' ' 69' ' ' SER . 26.3 p90 -149.59 164.47 35.03 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.626 -1.296 . . . . 0.0 110.152 167.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.65 124.31 4.94 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 167.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.84 124.89 28.68 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 161.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -123.21 115.51 21.87 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 166.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 70.24 -96.77 0.56 Allowed Glycine 0 CA--C 1.523 0.575 0 C-N-CA 124.102 0.858 . . . . 0.0 112.817 175.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -136.29 21.31 3.19 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.572 1.949 . . . . 0.0 110.364 -177.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.0 m -125.97 149.28 48.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.63 1.572 . . . . 0.0 107.368 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 60.0 t -122.41 130.54 74.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.376 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 166.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 1.1 mp -106.66 92.82 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.6 mt -77.87 129.91 36.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -131.06 98.12 4.49 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 125.535 1.534 . . . . 0.0 107.089 -174.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -124.15 164.65 19.04 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.613 -1.305 . . . . 0.0 110.461 -168.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.1 t -156.49 160.51 39.61 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.121 0.568 . . . . 0.0 109.64 174.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.9 p -108.7 8.2 26.78 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.17 1.788 . . . . 0.0 110.987 171.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -152.63 101.97 2.68 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 127.148 2.179 . . . . 0.0 106.711 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 tpt180 -44.26 -50.61 8.84 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 130.92 3.688 . . . . 0.0 110.594 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.35 3.5 8.94 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -176.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.0 p -119.85 165.52 14.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.849 0.356 . . . . 0.0 110.903 171.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.404 ' HE2' ' O ' ' A' ' 103' ' ' LEU . 10.5 ptmt -65.49 173.28 2.77 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 122.669 1.223 . . . . 0.0 111.379 -177.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.404 ' O ' ' HE2' ' A' ' 102' ' ' LYS . 2.9 mm? -82.3 153.49 25.8 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.84 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.68 -179.7 1.86 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.855 0.862 . . . . 0.0 109.024 156.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -138.61 120.0 14.86 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.559 1.144 . . . . 0.0 108.211 169.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 mttm -112.08 106.27 14.86 Favored 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 158.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -84.06 135.48 34.4 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 160.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -134.48 158.17 44.62 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.774 1.63 . . . . 0.0 106.763 169.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.9 p -69.42 155.13 40.95 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.634 161.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.0 mt -58.4 -30.54 66.92 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.703 -0.623 . . . . 0.0 111.313 169.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.0 t -64.76 -44.05 91.33 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 117.323 -1.322 . . . . 0.0 111.447 173.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -57.08 10.37 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 120.053 1.297 . . . . 0.0 109.561 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 16.0 mt -58.49 -44.85 89.54 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.314 1.445 . . . . 0.0 111.156 -179.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -61.22 -38.69 87.51 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.529 -0.732 . . . . 0.0 110.944 177.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -81.74 -19.25 41.79 Favored 'General case' 0 C--O 1.223 -0.329 0 O-C-N 120.463 -1.398 . . . . 0.0 111.127 -175.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -79.03 -50.64 10.76 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.544 1.138 . . . . 0.0 111.328 171.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -123.03 18.1 10.04 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 121.16 -0.962 . . . . 0.0 112.608 -165.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.428 ' CZ ' ' HE2' ' A' ' 124' ' ' LYS . 2.9 t80 -148.39 30.99 0.83 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 120.535 -1.353 . . . . 0.0 110.066 175.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.625 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.4 OUTLIER -63.97 -65.2 0.71 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 -176.065 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.5 p -75.89 175.77 8.46 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.617 0.767 . . . . 0.0 111.285 -169.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -42.38 11.98 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 121.116 -0.99 . . . . 0.0 110.235 173.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.2 m -57.77 -39.84 78.4 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-N 118.923 0.783 . . . . 0.0 111.374 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.625 HE22 ' NE2' ' A' ' 119' ' ' GLN . 7.8 tt0 -58.65 -25.54 62.87 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.225 1.01 . . . . 0.0 111.976 -178.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.428 ' HE2' ' CZ ' ' A' ' 118' ' ' TYR . 7.7 mtpt -63.47 -21.26 66.21 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.532 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -65.35 -64.3 0.89 Allowed 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 167.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -48.74 76.38 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 123.405 0.682 . . . . 0.0 112.254 -168.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.12 -54.04 31.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -66.13 -18.25 65.23 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -75.25 -44.08 48.01 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 125.461 1.504 . . . . 0.0 109.735 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -59.67 -32.02 70.1 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.848 0.859 . . . . 0.0 110.07 171.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 38.8 t -69.96 -20.53 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 O-C-N 120.654 -1.279 . . . . 0.0 111.977 172.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -118.39 20.98 12.88 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.92 1.288 . . . . 0.0 111.438 -173.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -134.75 18.41 4.08 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 127.315 2.388 . . . . 0.0 110.857 169.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -90.55 164.95 14.03 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 123.976 0.911 . . . . 0.0 110.151 169.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.47 165.36 11.08 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.719 1.608 . . . . 0.0 107.157 162.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -136.15 -4.96 2.12 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 124.519 1.127 . . . . 0.0 111.776 -167.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 . . . . . 0 C--O 1.247 0.931 0 C-N-CA 131.246 3.818 . . . . 0.0 102.638 -172.585 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 . . . . . 0 N--CA 1.451 -0.408 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 p -121.09 162.62 19.72 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 161.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -62.7 -35.13 78.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.561 0.696 . . . . 0.0 110.3 -165.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -43.3 95.27 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.486 1.115 . . . . 0.0 110.59 177.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -58.68 -47.52 84.22 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.836 0.854 . . . . 0.0 108.748 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 88.0 mt -65.07 -41.9 93.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 123.722 0.809 . . . . 0.0 109.371 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.65 -43.75 91.31 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 123.657 0.646 . . . . 0.0 112.667 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.9 t -60.76 -51.62 71.07 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 C-N-CA 123.493 0.717 . . . . 0.0 109.34 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.3 -33.39 75.4 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.532 1.06 . . . . 0.0 111.76 -175.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.1 95.23 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 122.835 0.454 . . . . 0.0 110.033 173.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.84 7.09 44.4 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-O 118.445 -1.197 . . . . 0.0 113.091 173.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -100.8 -8.9 22.23 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 119.788 1.794 . . . . 0.0 111.753 162.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -98.99 -10.03 23.21 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.157 0.983 . . . . 0.0 113.414 173.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.5 mm -139.73 93.61 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 129.684 3.194 . . . . 0.0 107.484 -172.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 63.01 73.42 0.51 Allowed Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -78.86 -30.31 2.94 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.439 2.093 . . . . 0.0 111.588 -171.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.51 -44.22 91.6 Favored 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 125.391 1.476 . . . . 0.0 109.743 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 63.9 t90 -52.37 -62.54 1.58 Allowed 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 125.172 1.389 . . . . 0.0 110.093 168.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.0 tt -52.16 -51.94 54.9 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 118.704 0.684 . . . . 0.0 111.471 -175.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.1 mttm -59.25 -44.92 92.36 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.343 -0.837 . . . . 0.0 111.413 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -60.98 -45.48 94.61 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.633 1.106 . . . . 0.0 110.631 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -58.26 -42.88 87.4 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 29.6 mm -64.78 -46.11 93.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 118.741 0.7 . . . . 0.0 110.178 176.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.36 -20.27 53.41 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.618 1.099 . . . . 0.0 112.311 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -102.16 1.14 35.73 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.623 1.569 . . . . 0.0 112.623 174.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 44.95 33.96 1.14 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.497 2.319 . . . . 0.0 111.14 -170.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -88.97 -18.08 28.16 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.802 2.041 . . . . 0.0 112.976 -173.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.88 130.5 37.67 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.484 1.514 . . . . 0.0 109.458 -163.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 55.6 t -108.52 156.9 8.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-O 122.955 1.359 . . . . 0.0 108.215 172.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -126.96 138.37 53.26 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.516 2.326 . . . . 0.0 105.249 176.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -161.62 -178.84 35.89 Favored Glycine 0 N--CA 1.445 -0.724 0 CA-C-O 122.241 0.912 . . . . 0.0 112.428 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.4 mm -124.48 134.85 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 C-N-CA 129.161 2.984 . . . . 0.0 104.73 -173.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.3 t -44.73 -53.96 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 C-N-CA 124.104 0.962 . . . . 0.0 113.287 -176.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.9 mmtt 65.16 156.31 0.12 Allowed Pre-proline 0 CA--C 1.532 0.257 0 C-N-CA 129.213 3.005 . . . . 0.0 111.09 -171.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.96 -3.11 7.74 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 124.103 3.202 . . . . 0.0 113.897 -176.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -120.02 -2.41 10.25 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.796 -1.19 . . . . 0.0 113.904 -162.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -89.58 173.01 8.55 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 120.814 1.643 . . . . 0.0 113.471 -170.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.6 t -76.33 35.75 0.15 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 129.51 3.124 . . . . 0.0 112.682 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.5 m -90.33 151.87 45.0 Favored Pre-proline 0 CA--C 1.536 0.441 0 O-C-N 120.675 -1.266 . . . . 0.0 113.502 -163.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.0 158.11 56.21 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.398 2.732 . . . . 0.0 110.278 176.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.93 144.27 56.33 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 123.393 0.677 . . . . 0.0 109.479 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.85 20.89 45.04 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-N 119.164 0.893 . . . . 0.0 113.429 176.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.4 m -140.29 90.81 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 104.308 -2.479 . . . . 0.0 104.308 166.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -92.42 -15.89 26.61 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -169.7 46.37 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.999 1.72 . . . . 0.0 110.956 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -94.9 114.96 26.87 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 162.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.83 154.41 7.18 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.439 1.018 . . . . 0.0 110.424 173.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 38.7 p90 -130.78 153.74 48.74 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.326 0.651 . . . . 0.0 110.447 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -119.1 134.45 55.19 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 126.767 2.027 . . . . 0.0 106.573 170.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.6 p -147.89 158.42 8.38 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 N-CA-C 104.722 -2.325 . . . . 0.0 104.722 171.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.75 164.6 17.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.931 1.241 . . . . 0.0 107.905 168.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.63 0.4 26.6 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 121.354 -0.841 . . . . 0.0 112.807 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -137.87 4.03 2.51 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.492 1.042 . . . . 0.0 112.678 -168.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -128.31 34.0 4.62 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.483 1.913 . . . . 0.0 109.569 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -56.79 -13.38 2.51 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -163.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.42 7.06 7.67 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 121.064 1.756 . . . . 0.0 111.893 174.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -82.38 -71.28 1.31 Allowed Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 126.494 1.997 . . . . 0.0 110.065 -178.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.8 m -118.79 171.13 8.43 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 117.981 0.891 . . . . 0.0 109.462 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.0 tt -168.32 148.52 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.521 0 C-N-CA 126.958 2.103 . . . . 0.0 106.945 158.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 73.5 mt -132.58 131.2 60.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.106 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 173.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -105.52 151.5 24.22 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 125.583 1.553 . . . . 0.0 108.69 172.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -144.08 156.93 44.56 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.678 1.191 . . . . 0.0 108.783 170.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.0 tttt -144.91 134.53 23.36 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 161.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.41 123.22 21.24 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 159.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -99.09 23.16 9.38 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.013 0.925 . . . . 0.0 109.037 165.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 76.8 115.08 0.14 Allowed Glycine 0 C--N 1.34 0.772 0 C-N-CA 125.963 1.744 . . . . 0.0 110.821 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 61.54 0.77 0.5 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.718 1.607 . . . . 0.0 113.645 -173.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.41 149.78 38.13 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.556 2.342 . . . . 0.0 106.628 177.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.78 129.57 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 172.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 19.4 mm -100.09 112.96 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 174.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.5 mt -101.43 118.07 47.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -116.72 104.99 11.91 Favored 'General case' 0 C--O 1.223 -0.306 0 C-N-CA 126.936 2.094 . . . . 0.0 107.17 -172.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -125.79 169.71 12.33 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.164 -1.585 . . . . 0.0 110.761 -177.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.1 t -151.26 168.7 23.94 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.149 1.38 . . . . 0.0 108.317 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.9 p -88.65 -12.73 41.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.664 1.185 . . . . 0.0 113.178 167.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -150.1 137.36 19.64 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.55 0.74 . . . . 0.0 109.771 -174.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -60.14 -21.03 61.11 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.577 1.551 . . . . 0.0 112.04 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -94.47 2.4 55.73 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.6 p -121.88 156.35 33.5 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.352 0.978 . . . . 0.0 112.771 -172.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.2 tmtt? -64.4 135.62 56.3 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 124.63 1.172 . . . . 0.0 109.819 -169.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 83.4 mt -72.81 143.9 47.71 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 123.984 0.914 . . . . 0.0 109.763 -176.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -71.24 -171.69 0.62 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.226 1.41 . . . . 0.0 109.439 171.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.93 103.91 4.09 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.114 -0.991 . . . . 0.0 110.172 170.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -85.3 147.53 26.5 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 106.147 -1.797 . . . . 0.0 106.147 147.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -137.5 127.31 25.53 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 168.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.4 mt -141.67 139.26 32.94 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -168.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 16.9 p -69.28 154.64 41.71 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.319 0.963 . . . . 0.0 109.873 173.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 20.4 mt -59.45 -28.54 67.08 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.314 -0.866 . . . . 0.0 110.046 168.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.46 -29.94 65.44 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.81 -0.556 . . . . 0.0 112.329 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.11 -59.84 2.66 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 105.856 -1.905 . . . . 0.0 105.856 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.61 -37.08 72.67 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.76 1.224 . . . . 0.0 113.138 -175.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -70.57 -31.75 68.89 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.49 -0.756 . . . . 0.0 110.21 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -63.02 1.14 Allowed 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 174.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -46.88 -53.55 11.89 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.315 1.446 . . . . 0.0 111.59 -173.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -119.14 11.46 12.38 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 121.827 -0.546 . . . . 0.0 111.953 -163.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -149.44 34.85 0.71 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.637 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -81.08 -40.33 24.29 Favored 'General case' 0 C--N 1.342 0.278 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.334 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 16.6 p -89.02 -178.84 5.79 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.899 1.681 . . . . 0.0 110.543 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 -88.45 -45.41 9.98 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 120.994 -1.066 . . . . 0.0 109.314 170.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 37.3 p -66.63 -30.27 70.51 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.301 0.955 . . . . 0.0 111.213 -175.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.637 HE22 ' NE2' ' A' ' 119' ' ' GLN . 12.0 tt0 -58.43 -30.96 67.31 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.256 0.934 . . . . 0.0 110.618 176.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -59.76 -27.22 66.34 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 121.612 -0.68 . . . . 0.0 111.78 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.18 -50.23 61.76 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.045 1.338 . . . . 0.0 108.853 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.85 -48.68 75.78 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.679 0.752 . . . . 0.0 111.815 176.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 54.8 t -53.98 -54.48 20.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.382 -177.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -63.79 -24.99 67.98 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 177.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -64.08 -43.66 94.73 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.852 0.751 . . . . 0.0 110.244 171.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -60.05 -37.07 78.75 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.619 1.099 . . . . 0.0 110.418 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 22.0 t -71.05 -8.85 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 123.626 0.77 . . . . 0.0 111.61 178.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -117.57 -14.53 10.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.741 1.216 . . . . 0.0 113.376 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -97.86 -5.37 57.54 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 125.793 1.663 . . . . 0.0 112.716 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -68.32 170.95 7.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 122.205 1.002 . . . . 0.0 110.352 165.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -127.49 174.43 9.03 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 126.927 2.091 . . . . 0.0 107.357 172.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.9 m -149.0 16.97 0.96 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.674 1.125 . . . . 0.0 112.722 -171.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 C--O 1.252 1.222 0 C-N-CA 125.732 1.613 . . . . 0.0 108.918 -171.243 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 12.0 m-30 . . . . . 0 CA--C 1.544 0.749 0 CA-C-O 121.178 0.513 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -138.66 150.73 46.53 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 129.313 3.045 . . . . 0.0 107.972 177.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -51.07 -40.95 59.53 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.978 0.911 . . . . 0.0 110.188 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -53.19 -59.47 4.52 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.459 1.503 . . . . 0.0 112.52 174.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -63.46 -26.16 68.6 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.608 1.563 . . . . 0.0 111.407 -175.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 93.1 mt -78.55 -40.62 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 C-N-CA 125.184 1.394 . . . . 0.0 109.742 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.7 -40.66 89.03 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 124.679 1.133 . . . . 0.0 112.431 -175.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.8 t -66.29 -49.37 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.3 mp -54.05 -49.6 68.64 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.202 0.91 . . . . 0.0 110.68 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.6 -38.01 86.04 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.1 0.56 . . . . 0.0 111.248 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.88 -32.58 73.82 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 111.81 -0.516 . . . . 0.0 111.81 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.0 mt -64.94 -23.32 67.19 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 120.468 -1.607 . . . . 0.0 111.671 176.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.98 -17.59 52.51 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.358 -0.839 . . . . 0.0 112.96 171.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mp -134.52 97.73 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 125.797 1.639 . . . . 0.0 107.428 -172.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.92 54.96 1.25 Allowed Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.02 0.928 . . . . 0.0 110.605 175.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -56.05 -39.57 90.39 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 123.262 2.641 . . . . 0.0 111.246 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -67.34 -34.4 77.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.803 1.241 . . . . 0.0 112.527 -175.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 34.9 t90 -63.68 -54.33 37.22 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 173.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 tt -50.96 -48.4 61.01 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.158 0.583 . . . . 0.0 110.748 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -59.32 -47.42 85.48 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.904 0.882 . . . . 0.0 111.306 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -58.58 -40.21 82.51 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 120.779 1.627 . . . . 0.0 112.346 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -67.01 -45.02 78.85 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.991 0.9 . . . . 0.0 109.205 -177.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 96.1 mt -71.8 -32.32 44.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 O-C-N 121.422 -0.799 . . . . 0.0 109.52 -178.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.83 -4.17 33.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.88 0.872 . . . . 0.0 112.581 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.0 -16.24 26.79 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.134 0.879 . . . . 0.0 111.673 160.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 68.83 30.26 4.81 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 127.829 2.452 . . . . 0.0 109.287 -170.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -94.96 -89.15 0.24 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 119.023 -0.513 . . . . 0.0 109.66 178.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.314 13.0 tp 40.9 97.28 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 129.592 3.157 . . . . 0.0 113.921 175.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.9 t -96.14 143.51 12.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 120.096 1.316 . . . . 0.0 109.003 -177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -119.65 137.35 53.94 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 128.139 2.576 . . . . 0.0 107.831 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.15 174.77 32.56 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 176.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.6 mm -116.99 146.2 21.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 172.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.5 t -49.91 -77.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 126.299 1.84 . . . . 0.0 110.755 176.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.6 mttt 57.47 165.81 0.07 OUTLIER Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 125.833 1.653 . . . . 0.0 111.77 -165.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -75.46 -32.85 4.57 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 CA-C-N 120.332 1.154 . . . . 0.0 112.777 -176.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 47.2 t -80.11 67.55 5.96 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.061 1.345 . . . . 0.0 109.043 -177.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -157.2 -167.19 2.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.033 1.733 . . . . 0.0 107.29 159.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.2 m -109.85 105.13 14.21 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 120.238 1.381 . . . . 0.0 107.622 174.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -138.08 159.21 69.25 Favored Pre-proline 0 C--O 1.237 0.446 0 CA-C-N 118.995 0.816 . . . . 0.0 112.709 -171.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -72.86 164.38 35.73 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.467 2.778 . . . . 0.0 111.263 173.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.52 137.68 58.31 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.581 169.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.2 31.42 11.9 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-O 119.392 -0.671 . . . . 0.0 113.725 164.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 13.9 m -135.74 22.72 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-N 118.549 1.175 . . . . 0.0 109.988 171.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -63.27 -9.59 12.26 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 116.928 2.196 . . . . 0.0 116.928 -150.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -147.52 26.61 1.04 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 128.703 2.801 . . . . 0.0 111.324 172.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -78.49 153.93 30.95 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.064 0.946 . . . . 0.0 109.254 176.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.2 m -76.17 151.73 36.85 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 124.499 1.12 . . . . 0.0 108.684 163.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -133.85 145.56 49.8 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 124.129 0.972 . . . . 0.0 110.375 167.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 18.6 mt -115.75 137.77 51.76 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.406 1.883 . . . . 0.0 106.213 175.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 p -149.66 167.8 2.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 104.425 -2.435 . . . . 0.0 104.425 -179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -109.75 153.59 24.12 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 120.213 -1.555 . . . . 0.0 108.326 167.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.52 3.02 12.22 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -100.33 -47.85 4.78 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 118.866 0.757 . . . . 0.0 109.977 159.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -76.58 24.91 0.14 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.138 1.775 . . . . 0.0 112.453 -174.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -56.09 -28.87 59.44 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.555 1.542 . . . . 0.0 113.683 -164.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -128.0 11.71 6.59 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 127.139 2.176 . . . . 0.0 111.174 174.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -88.18 -56.92 1.97 Allowed Glycine 0 CA--C 1.53 0.98 0 C-N-CA 125.369 1.461 . . . . 0.0 111.105 176.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 75.0 m -127.97 161.4 29.22 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.102 1.361 . . . . 0.0 108.016 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.8 tt -156.98 154.85 5.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 O-C-N 120.382 -1.449 . . . . 0.0 107.671 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 64.5 mt -135.02 150.42 29.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 169.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -124.24 158.86 31.49 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 126.977 2.111 . . . . 0.0 108.917 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -162.72 162.74 26.93 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.974 0.909 . . . . 0.0 110.1 171.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.5 131.09 10.63 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 170.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.78 150.38 24.61 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 123.957 0.785 . . . . 0.0 109.554 171.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -117.04 -3.45 11.57 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.256 1.822 . . . . 0.0 111.253 174.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 135.96 -37.19 1.93 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 124.879 1.228 . . . . 0.0 112.258 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -131.13 -59.54 0.98 Allowed 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 125.951 1.7 . . . . 0.0 107.14 166.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.4 m -73.16 143.07 47.39 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 119.604 -1.935 . . . . 0.0 110.559 -175.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 71.3 t -133.35 116.06 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 -175.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.8 mp -84.36 94.71 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.4 mt -71.24 127.94 33.8 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 171.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.9 mttt -129.01 108.34 10.32 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -129.37 168.47 16.23 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 121.133 -0.979 . . . . 0.0 109.938 -171.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.5 t -154.63 169.62 23.44 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.524 1.129 . . . . 0.0 108.778 -176.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.6 p -99.32 -14.02 19.39 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.661 0.784 . . . . 0.0 111.86 162.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -134.71 126.93 30.02 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.337 1.055 . . . . 0.0 111.556 -176.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 57.4 ttt-85 -56.59 -30.33 63.07 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 126.681 1.992 . . . . 0.0 112.579 -173.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.92 50.28 1.09 Allowed 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 124.767 1.227 . . . . 0.0 109.889 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.1 p -135.74 156.69 48.43 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.245 1.018 . . . . 0.0 108.511 164.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.33 149.17 46.38 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.247 -0.908 . . . . 0.0 111.15 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -83.89 154.54 23.37 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.983 1.313 . . . . 0.0 110.97 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -71.44 171.29 11.55 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 125.876 1.671 . . . . 0.0 111.112 171.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -114.92 117.26 30.15 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.479 1.512 . . . . 0.0 108.565 167.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.61 115.62 14.06 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 104.114 -2.55 . . . . 0.0 104.114 156.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.09 122.39 39.94 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 -172.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 35.6 mt -138.46 145.55 41.0 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.567 1.147 . . . . 0.0 108.674 -168.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 20.7 p -77.18 151.63 35.18 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.313 0.506 . . . . 0.0 110.73 175.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.3 mt -51.0 -42.08 60.11 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 122.237 1.017 . . . . 0.0 110.807 175.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -35.89 70.49 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 125.091 1.357 . . . . 0.0 111.547 -176.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -68.03 0.37 Allowed 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 126.575 1.95 . . . . 0.0 109.652 174.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.61 -38.02 71.48 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.657 1.183 . . . . 0.0 111.279 -173.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -60.32 -34.14 73.38 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.956 0.502 . . . . 0.0 112.155 176.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -58.94 3.38 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 120.787 -1.195 . . . . 0.0 108.069 173.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -45.87 -57.25 4.49 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.97 2.108 . . . . 0.0 110.537 -175.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -120.49 12.81 11.66 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.041 1.336 . . . . 0.0 112.298 -163.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -147.84 28.44 0.94 Allowed 'General case' 0 C--N 1.342 0.268 0 CA-C-N 120.08 1.309 . . . . 0.0 114.19 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.592 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -68.82 -60.14 2.59 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 120.758 -1.214 . . . . 0.0 111.915 179.543 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 11.0 t -99.6 163.63 12.42 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 125.362 1.465 . . . . 0.0 109.88 -164.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 53.2 mtt-85 -80.2 -38.29 31.48 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -167.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 8.1 t -57.45 -38.63 74.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.708 0.686 . . . . 0.0 109.654 174.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.592 HE22 ' NE2' ' A' ' 119' ' ' GLN . 13.0 tt0 -62.94 -25.31 68.28 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.684 -0.635 . . . . 0.0 112.368 176.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -71.66 -12.86 61.55 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 117.511 -1.233 . . . . 0.0 111.885 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -71.19 -73.07 0.19 Allowed 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 115.993 -1.956 . . . . 0.0 106.353 162.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -47.71 -55.14 10.16 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 120.243 1.383 . . . . 0.0 112.437 -166.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 78.3 t -54.45 -50.14 60.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 123.59 0.756 . . . . 0.0 110.391 -175.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.71 -34.03 73.33 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 176.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -64.14 -31.62 72.88 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 125.816 1.646 . . . . 0.0 108.835 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -68.39 -41.42 80.56 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.348 1.459 . . . . 0.0 110.957 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.67 -35.14 74.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-N 119.296 0.953 . . . . 0.0 109.288 172.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -80.56 10.09 5.22 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.913 -1.117 . . . . 0.0 112.712 172.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -129.72 -5.15 4.56 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 125.954 1.74 . . . . 0.0 112.181 -172.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.0 pp -84.38 176.42 8.7 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 118.15 0.975 . . . . 0.0 110.377 167.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -138.2 163.37 31.88 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 128.7 2.8 . . . . 0.0 105.536 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.42 -5.79 15.1 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.244 1.021 . . . . 0.0 110.71 178.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 . . . . . 0 C--O 1.254 1.311 0 C-N-CA 130.169 3.387 . . . . 0.0 105.955 -177.329 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 . . . . . 0 CA--C 1.537 0.464 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.88 152.69 49.08 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.492 1.117 . . . . 0.0 110.124 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -48.44 -41.38 29.18 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.496 1.118 . . . . 0.0 110.193 173.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -50.31 -63.58 1.08 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.406 2.282 . . . . 0.0 110.487 174.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -70.34 -32.9 70.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.835 2.054 . . . . 0.0 111.354 -172.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 88.2 mt -71.93 -33.94 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 124.613 1.165 . . . . 0.0 108.818 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.36 -46.71 63.74 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 125.157 1.361 . . . . 0.0 111.06 -174.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 65.0 t -67.84 -46.62 81.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 123.276 0.63 . . . . 0.0 109.433 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.7 mp -58.78 -51.91 67.95 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.563 0.745 . . . . 0.0 111.503 -179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.18 86.7 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.739 -0.648 . . . . 0.0 111.198 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.61 -28.6 72.07 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 118.79 0.723 . . . . 0.0 111.956 176.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mp -65.38 -24.93 67.36 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.35 -1.676 . . . . 0.0 112.44 176.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.57 -22.42 47.16 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 118.813 -0.613 . . . . 0.0 112.611 171.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mp -130.1 92.12 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.519 1.528 . . . . 0.0 107.017 -172.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.16 63.78 1.08 Allowed Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 124.61 1.164 . . . . 0.0 111.594 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -59.31 -35.36 97.06 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.576 2.184 . . . . 0.0 111.165 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -68.86 -49.84 54.94 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.95 -175.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 59.5 t90 -52.22 -50.73 61.39 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 118.826 0.739 . . . . 0.0 109.796 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.1 tt -53.68 -59.27 4.83 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -62.86 -32.66 73.94 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 117.86 -1.067 . . . . 0.0 112.372 -175.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -63.85 -48.51 76.46 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 120.228 1.376 . . . . 0.0 108.858 176.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -65.85 -34.35 77.94 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 118.384 -0.817 . . . . 0.0 111.883 -177.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 45.1 mm -61.77 -49.72 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 119.428 1.013 . . . . 0.0 109.37 170.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.73 -3.08 4.27 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.083 0.953 . . . . 0.0 113.324 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.84 -7.07 14.21 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.645 1.978 . . . . 0.0 112.378 172.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.9 t30 44.61 38.67 2.83 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.171 2.188 . . . . 0.0 111.203 -167.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.37 -5.07 19.29 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.491 1.517 . . . . 0.0 111.438 -175.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.62 138.61 36.44 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 92.9 t -118.0 150.47 20.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 126.316 1.846 . . . . 0.0 106.784 175.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -124.82 142.83 51.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.258 3.023 . . . . 0.0 105.616 174.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -167.24 -178.95 39.88 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 27.8 mm -119.1 137.55 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 125.76 1.624 . . . . 0.0 106.83 -176.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.8 t -43.99 -71.98 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.725 1.21 . . . . 0.0 112.606 175.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 47.0 mttt 55.06 165.04 0.05 OUTLIER Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.708 1.603 . . . . 0.0 113.03 -164.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -78.84 -22.22 9.06 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 121.008 1.138 . . . . 0.0 111.009 175.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.9 m -77.29 19.56 0.33 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.189 1.796 . . . . 0.0 113.743 -172.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -132.8 177.89 7.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.598 1.559 . . . . 0.0 109.124 176.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.1 m -91.33 112.08 23.84 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.849 1.26 . . . . 0.0 107.902 173.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.7 m -144.47 162.23 40.37 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 123.665 0.786 . . . . 0.0 110.429 -177.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.25 -172.83 1.11 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.315 2.677 . . . . 0.0 112.211 171.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.04 162.23 28.56 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.297 1.039 . . . . 0.0 111.552 165.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.32 33.64 78.2 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 123.93 0.776 . . . . 0.0 113.514 160.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.9 m -144.14 27.15 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 118.39 1.095 . . . . 0.0 111.606 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.79 -16.35 4.34 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -163.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -149.62 15.4 0.87 Allowed 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 128.352 2.661 . . . . 0.0 110.424 -170.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -74.68 132.08 41.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.6 m -68.03 149.33 49.83 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 166.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -136.71 164.32 28.51 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.388 -0.82 . . . . 0.0 110.689 173.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 16.7 mt -139.23 135.88 34.39 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 126.968 2.107 . . . . 0.0 105.878 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 11.8 p -156.17 158.26 3.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -174.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.401 ' HB1' ' H ' ' A' ' 76' ' ' ASP . . . -84.97 154.31 22.23 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.107 -0.996 . . . . 0.0 108.391 168.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.49 -16.01 62.86 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.452 -0.785 . . . . 0.0 112.9 175.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -104.03 -39.19 6.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.667 173.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.401 ' H ' ' HB1' ' A' ' 73' ' ' ALA . 1.7 m-20 -82.15 28.79 0.43 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.634 1.174 . . . . 0.0 110.548 -167.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -49.71 -53.66 23.38 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 126.491 1.916 . . . . 0.0 110.534 -169.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -92.51 7.97 40.85 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.045 1.338 . . . . 0.0 113.045 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.2 -68.54 1.02 Allowed Glycine 0 CA--C 1.529 0.919 0 C-N-CA 126.263 1.887 . . . . 0.0 111.432 -176.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.7 m -134.8 143.09 46.88 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.814 1.307 . . . . 0.0 108.987 173.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.6 tt -143.44 157.89 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 171.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.2 mt -141.8 137.91 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 176.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -118.09 156.35 28.8 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 124.646 1.178 . . . . 0.0 108.64 176.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -161.02 158.47 27.94 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 120.997 -1.064 . . . . 0.0 110.593 174.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.53 110.16 4.67 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 166.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.24 124.71 32.19 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -151.87 150.79 30.48 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.307 2.243 . . . . 0.0 110.769 -177.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 46.42 53.4 9.66 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.872 1.225 . . . . 0.0 113.815 171.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 53.9 mm-40 57.73 12.11 1.54 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.498 1.919 . . . . 0.0 115.069 -172.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.5 m -128.08 170.23 13.17 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 128.443 2.697 . . . . 0.0 109.119 -168.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.6 p -156.05 109.59 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.689 0 O-C-N 121.003 -1.061 . . . . 0.0 112.616 174.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 1.6 mp -79.03 95.38 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 173.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 19.2 mt -76.34 128.16 37.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 165.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -118.02 110.75 18.05 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 126.366 1.866 . . . . 0.0 106.405 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -126.78 164.96 20.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.146 0.884 . . . . 0.0 112.913 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.6 t -148.75 172.03 15.26 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.958 1.703 . . . . 0.0 108.615 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.6 p -114.93 -1.41 13.13 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.729 1.612 . . . . 0.0 111.953 169.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -143.21 143.28 31.69 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 160.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.0 mtm180 -60.44 -10.87 5.46 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -101.84 1.27 36.88 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.8 p -113.24 156.36 23.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.132 0.967 . . . . 0.0 112.612 -174.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -64.68 132.69 50.39 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 125.847 1.659 . . . . 0.0 109.926 -168.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.4 mt -78.23 140.58 38.9 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -173.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -66.9 -174.33 0.32 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.676 1.19 . . . . 0.0 110.793 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.32 101.83 4.63 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.381 1.072 . . . . 0.0 108.996 178.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -121.29 113.24 19.65 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 103.81 -2.663 . . . . 0.0 103.81 174.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -126.58 106.1 9.18 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 116.319 -1.8 . . . . 0.0 108.031 -166.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 26.7 mt -128.2 154.7 45.52 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 120.71 1.595 . . . . 0.0 109.143 -158.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 22.1 p -73.79 147.21 43.62 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 121.258 1.845 . . . . 0.0 111.44 176.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.6 mt -46.7 -48.89 20.13 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 122.919 1.343 . . . . 0.0 109.77 167.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.24 -15.69 62.46 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.01 0.924 . . . . 0.0 112.281 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -75.83 -56.47 4.64 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 171.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -55.14 -37.61 67.17 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.827 1.194 . . . . 0.0 111.834 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -56.83 -47.72 79.67 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.848 -0.533 . . . . 0.0 110.293 173.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -20.37 63.37 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.164 -0.922 . . . . 0.0 112.564 -176.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -83.01 -57.47 3.27 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.532 0.733 . . . . 0.0 110.952 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -116.28 0.94 13.0 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.391 -0.818 . . . . 0.0 113.064 -163.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -138.18 26.9 2.64 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -174.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.82 -26.96 40.33 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 174.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 66.2 p -80.09 -165.54 0.86 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.187 0.903 . . . . 0.0 110.972 -168.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 24.7 ttm-85 -114.53 -33.3 5.61 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.486 1.114 . . . . 0.0 111.779 172.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.3 p -62.11 -48.09 81.72 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 126.311 1.845 . . . . 0.0 110.874 174.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -58.03 -25.79 61.6 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -172.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -65.44 -4.43 5.71 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.018 1.327 . . . . 0.0 112.774 175.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -80.08 -83.51 0.1 Allowed 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 105.255 -2.128 . . . . 0.0 105.255 154.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -55.01 -56.46 19.46 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 124.168 0.987 . . . . 0.0 113.533 -160.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.17 -21.77 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.131 0.972 . . . . 0.0 111.483 -175.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.62 -39.42 14.08 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.243 1.817 . . . . 0.0 109.924 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -59.55 -40.05 86.01 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 126.987 2.115 . . . . 0.0 110.667 174.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -60.54 -33.08 72.14 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 125.201 1.4 . . . . 0.0 110.783 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 24.2 t -68.58 -13.9 17.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 O-C-N 121.583 -0.698 . . . . 0.0 110.772 175.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -116.08 17.64 15.74 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.286 1.434 . . . . 0.0 111.111 172.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -122.54 -10.61 5.91 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 126.214 1.864 . . . . 0.0 111.788 178.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.31 165.74 24.48 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.412 1.085 . . . . 0.0 108.928 157.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -110.81 162.49 14.74 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 127.426 2.29 . . . . 0.0 107.03 172.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.4 m -132.35 17.67 4.45 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.931 0.492 . . . . 0.0 110.376 176.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 . . . . . 0 C--O 1.25 1.122 0 C-N-CA 128.74 2.816 . . . . 0.0 108.15 -170.347 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 . . . . . 0 C--O 1.239 0.536 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 p -135.51 150.92 49.91 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 125.134 1.373 . . . . 0.0 108.585 177.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -57.35 -38.73 74.59 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.348 0.659 . . . . 0.0 110.819 -174.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -48.96 -61.28 2.14 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.465 2.306 . . . . 0.0 111.889 172.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 -66.74 -40.05 88.18 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.989 1.716 . . . . 0.0 109.456 -172.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.3 mt -61.89 -35.49 68.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.77 -51.05 59.31 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-O 118.187 -1.34 . . . . 0.0 111.232 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 76.3 t -58.3 -50.23 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 118.134 0.967 . . . . 0.0 109.18 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.4 mp -55.71 -49.82 71.99 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.259 1.024 . . . . 0.0 112.008 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.19 -42.78 93.25 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.919 -0.562 . . . . 0.0 111.32 -177.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.11 -25.24 74.54 Favored Glycine 0 C--N 1.337 0.629 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.095 176.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 tp -66.53 -24.15 66.34 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.307 -1.702 . . . . 0.0 111.74 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.92 -22.82 49.06 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 170.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.8 mp -136.59 101.34 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.543 1.537 . . . . 0.0 106.927 -170.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m 64.49 59.2 1.54 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.73 1.212 . . . . 0.0 112.904 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.82 -43.21 12.94 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.33 2.687 . . . . 0.0 112.165 176.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -53.74 -55.28 27.72 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.467 1.03 . . . . 0.0 110.164 -177.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 63.0 t90 -53.33 -42.17 66.46 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.61 1.164 . . . . 0.0 110.714 176.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.59 -53.6 32.67 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 -174.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -58.15 -44.22 87.74 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 123.857 0.863 . . . . 0.0 110.69 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -55.8 -52.35 64.31 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.939 0.896 . . . . 0.0 109.919 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -71.37 -24.39 62.07 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.498 -0.763 . . . . 0.0 111.482 -174.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 24.5 mm -72.18 -38.75 63.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 120.095 1.316 . . . . 0.0 110.579 167.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.09 -6.52 9.17 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.511 1.051 . . . . 0.0 112.756 -178.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.07 10.26 8.14 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.235 1.414 . . . . 0.0 112.267 167.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 50.67 27.44 2.98 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 128.78 2.832 . . . . 0.0 112.521 -178.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -82.77 -8.19 59.6 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 127.045 2.138 . . . . 0.0 112.823 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.8 tp -76.5 147.43 37.81 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.537 1.062 . . . . 0.0 110.225 -175.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.9 t -123.89 159.36 29.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 125.614 1.566 . . . . 0.0 107.782 170.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -129.65 144.54 51.33 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.669 2.787 . . . . 0.0 107.56 173.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -161.5 173.97 37.97 Favored Glycine 0 C--N 1.335 0.522 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 174.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 23.6 mm -106.3 147.77 11.42 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 168.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.7 t -50.72 -77.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 126.103 1.761 . . . . 0.0 112.346 173.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 38.3 mtmt 57.43 165.43 0.07 OUTLIER Pre-proline 0 CA--C 1.541 0.622 0 C-N-CA 126.477 1.911 . . . . 0.0 114.439 -170.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -78.83 64.62 8.76 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 123.078 2.518 . . . . 0.0 109.471 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.1 m -140.29 -17.02 0.92 Allowed 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.205 1.802 . . . . 0.0 112.728 -167.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -146.36 161.5 40.22 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 119.479 1.036 . . . . 0.0 108.985 -168.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 84.9 m -70.93 117.43 12.42 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 119.832 1.196 . . . . 0.0 107.969 173.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 30.4 m -139.96 159.37 64.76 Favored Pre-proline 0 C--O 1.236 0.352 0 C-N-CA 124.79 1.236 . . . . 0.0 109.161 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -72.13 -178.44 3.23 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 121.72 1.614 . . . . 0.0 109.882 169.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.09 163.34 28.3 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.355 169.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.79 16.83 69.33 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-O 118.201 -1.333 . . . . 0.0 114.067 166.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.2 m -141.35 19.06 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 CA-C-N 119.115 1.458 . . . . 0.0 113.427 -171.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -57.22 -12.72 2.49 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 127.101 2.16 . . . . 0.0 116.245 -167.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -142.99 14.78 1.9 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.489 1.516 . . . . 0.0 111.813 175.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -70.07 148.1 49.2 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.181 -0.949 . . . . 0.0 108.993 176.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.3 m -72.89 157.79 36.76 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 124.14 0.976 . . . . 0.0 109.779 163.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -136.21 162.17 33.72 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.645 1.178 . . . . 0.0 110.146 163.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 10.1 mt -133.98 136.44 44.13 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 171.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.5 p -154.19 -177.99 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 104.9 -2.259 . . . . 0.0 104.9 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -132.38 158.44 41.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 120.527 -1.358 . . . . 0.0 110.412 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.83 -17.26 62.75 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 125.653 1.581 . . . . 0.0 114.65 -161.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -117.41 -19.37 9.54 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.332 0.653 . . . . 0.0 111.404 175.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -88.82 38.35 0.88 Allowed 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.818 -1.176 . . . . 0.0 109.995 -178.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -50.98 -52.34 43.65 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.189 -0.944 . . . . 0.0 112.894 -167.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -95.86 2.68 53.83 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.946 0.499 . . . . 0.0 111.456 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.43 -66.66 1.96 Allowed Glycine 0 CA--C 1.527 0.833 0 C-N-CA 125.323 1.439 . . . . 0.0 112.602 -169.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.2 m -144.55 154.1 42.52 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.801 1.24 . . . . 0.0 107.707 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.6 tt -153.12 148.91 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-N 119.916 1.234 . . . . 0.0 108.161 174.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 mt -136.78 149.98 26.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 120.601 -1.312 . . . . 0.0 108.704 172.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -125.07 162.64 24.13 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 126.49 1.916 . . . . 0.0 109.369 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -162.16 160.36 27.08 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.103 -0.998 . . . . 0.0 111.777 175.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -142.88 111.34 6.21 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.907 0.883 . . . . 0.0 109.009 161.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -81.86 102.74 11.04 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 173.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -96.2 90.49 5.51 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 126.389 1.876 . . . . 0.0 106.385 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.91 -137.4 43.93 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.71 5.22 0.13 Allowed 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 116.473 -1.727 . . . . 0.0 115.187 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.0 157.21 44.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 121.657 2.026 . . . . 0.0 110.61 -175.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.4 p -137.12 118.65 18.44 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 O-C-N 120.908 -1.12 . . . . 0.0 113.552 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 13.5 mm -78.5 94.05 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 172.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 27.1 mt -67.68 125.5 25.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 164.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -121.69 95.36 4.64 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 176.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 51.3 p90 -110.11 163.71 13.33 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.563 -1.336 . . . . 0.0 111.653 -177.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -147.23 166.73 26.14 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 170.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.3 p -98.24 -12.09 21.98 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.355 1.462 . . . . 0.0 111.108 171.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -140.13 132.88 29.02 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.924 0.89 . . . . 0.0 108.714 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -55.38 -25.67 36.76 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.04 1.336 . . . . 0.0 112.208 177.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.14 -5.29 59.06 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 118.293 2.701 . . . . 0.0 118.293 -178.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.6 p -116.71 161.53 19.1 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.488 1.04 . . . . 0.0 113.774 -169.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.1 tmtt? -64.76 153.08 40.91 Favored 'General case' 0 C--N 1.346 0.419 0 C-N-CA 123.249 0.62 . . . . 0.0 109.71 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -88.01 139.58 30.37 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.211 0.529 . . . . 0.0 109.694 -174.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -61.45 174.32 0.76 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.961 0.904 . . . . 0.0 109.713 164.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -132.4 124.47 28.74 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 174.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -127.87 123.13 34.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 162.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.08 127.85 43.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 114.894 -2.479 . . . . 0.0 106.31 172.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -124.69 137.45 54.35 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 122.813 2.551 . . . . 0.0 108.479 179.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.9 p -64.6 148.43 50.87 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.213 172.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.5 mt -49.62 -42.21 44.34 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 121.35 0.595 . . . . 0.0 109.939 165.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.6 t -62.63 -45.77 91.32 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.459 -177.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -52.26 -61.02 2.54 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 118.551 0.614 . . . . 0.0 110.428 175.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.79 -32.62 72.92 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.714 0.265 . . . . 0.0 111.714 -171.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -66.12 -40.8 90.97 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.546 -0.721 . . . . 0.0 110.052 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -49.53 40.72 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 117.636 -1.173 . . . . 0.0 110.752 -177.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.16 -57.16 12.88 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.211 1.804 . . . . 0.0 108.367 177.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -118.55 16.49 13.73 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -159.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.509 ' CE1' ' HA ' ' A' ' 124' ' ' LYS . 1.5 t80 -147.21 26.59 1.07 Allowed 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -179.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.567 ' NE2' HE22 ' A' ' 123' ' ' GLN 0.272 0.0 OUTLIER -79.4 -52.96 7.39 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.891 -1.131 . . . . 0.0 113.793 -178.146 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.0 p -85.13 159.46 20.15 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.72 1.6 . . . . 0.0 111.638 -172.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -63.27 -45.05 93.3 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 116.774 -1.584 . . . . 0.0 113.932 176.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.7 t -61.49 -39.73 92.0 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 120.152 1.342 . . . . 0.0 108.815 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.567 HE22 ' NE2' ' A' ' 119' ' ' GLN . 11.7 tt0 -56.18 -39.21 72.03 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.509 ' HA ' ' CE1' ' A' ' 118' ' ' TYR . 7.0 mtpm? -58.54 -37.28 75.35 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 118.361 -0.828 . . . . 0.0 112.88 178.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -60.92 2.15 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.32 -52.79 33.75 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.253 1.421 . . . . 0.0 111.249 -177.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 91.1 t -55.67 -48.97 77.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 124.167 0.987 . . . . 0.0 111.194 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -67.12 -31.88 72.64 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.484 0.714 . . . . 0.0 111.663 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.31 -41.76 97.53 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.758 1.623 . . . . 0.0 109.913 175.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -61.01 -38.44 86.09 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 122.86 0.464 . . . . 0.0 112.102 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.3 t -64.07 -41.39 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.695 0.68 . . . . 0.0 109.793 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.37 -13.16 61.77 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -102.2 11.5 57.07 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.086 1.327 . . . . 0.0 113.541 -171.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.5 pp -117.22 173.17 6.83 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.108 0.963 . . . . 0.0 110.201 174.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -125.78 167.87 14.59 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 125.231 1.412 . . . . 0.0 108.174 -171.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.91 -6.12 6.18 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 122.306 1.05 . . . . 0.0 113.06 -175.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.061 1 C-N-CA 131.808 4.043 . . . . 0.0 104.983 -174.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 . . . . . 0 CA--C 1.536 0.407 0 CA-C-O 121.626 0.727 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.31 149.51 42.2 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 165.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -62.39 -35.38 79.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.69 -163.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -43.27 92.87 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.315 0.646 . . . . 0.0 109.907 -178.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -61.32 -36.48 80.23 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 123.257 0.623 . . . . 0.0 109.75 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.5 mt -69.2 -45.4 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -59.7 -36.58 90.23 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.257 -0.746 . . . . 0.0 113.468 -175.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.75 -48.7 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 117.732 0.766 . . . . 0.0 109.501 174.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.89 -44.21 96.7 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 118.719 0.691 . . . . 0.0 110.279 -178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.62 -43.92 72.67 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.763 0.825 . . . . 0.0 109.775 175.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.99 -35.3 78.5 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.7 mp -62.62 -18.19 61.76 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.274 2.037 . . . . 0.0 112.271 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -86.23 -17.38 34.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.633 1.573 . . . . 0.0 114.072 171.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mp -135.91 96.21 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 126.883 2.073 . . . . 0.0 106.902 -177.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 58.99 73.59 0.68 Allowed Pre-proline 0 CA--C 1.543 0.712 0 C-N-CA 127.59 2.356 . . . . 0.0 112.388 -178.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -60.34 -46.14 19.46 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.724 2.949 . . . . 0.0 111.916 172.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.33 -27.78 69.28 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.257 0.623 . . . . 0.0 112.042 -174.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -65.03 -65.13 0.71 Allowed 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.286 -0.884 . . . . 0.0 109.024 172.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 tt -52.16 -47.54 65.4 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.0 0.92 . . . . 0.0 110.724 -174.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -59.9 -46.94 87.74 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.65 0.78 . . . . 0.0 110.391 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -61.51 -41.7 97.7 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 119.092 0.86 . . . . 0.0 111.501 173.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -61.03 -49.07 78.88 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.788 0.722 . . . . 0.0 109.171 -176.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.5 mm -61.52 -34.35 61.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 123.938 0.895 . . . . 0.0 110.478 177.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.11 -9.01 19.28 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.933 -1.105 . . . . 0.0 112.931 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -123.46 10.7 9.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.305 1.042 . . . . 0.0 112.42 167.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 52.12 34.49 14.33 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.065 1.746 . . . . 0.0 111.938 -175.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -87.64 -0.64 57.16 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 126.941 2.097 . . . . 0.0 114.638 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 tp -90.69 134.51 34.36 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.371 1.068 . . . . 0.0 109.306 -171.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 53.8 t -118.63 153.53 20.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 126.062 1.745 . . . . 0.0 108.053 174.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -135.26 148.19 49.49 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 127.724 2.41 . . . . 0.0 107.451 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -163.38 173.4 39.51 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 170.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 25.4 mm -95.9 148.1 5.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 161.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -44.59 -59.19 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 C-N-CA 126.752 2.021 . . . . 0.0 113.647 178.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 mttt 58.77 165.41 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 126.348 1.859 . . . . 0.0 113.522 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -73.76 -25.29 14.73 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 121.837 1.691 . . . . 0.0 111.749 174.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.41 63.77 0.98 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.093 1.757 . . . . 0.0 110.399 -170.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -158.09 -169.23 2.73 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.482 2.313 . . . . 0.0 106.752 169.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 20.5 m -118.97 110.46 17.15 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 120.271 1.396 . . . . 0.0 108.725 172.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 31.6 m -135.44 163.09 53.32 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 124.89 1.276 . . . . 0.0 112.138 -175.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -75.61 172.86 15.5 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.111 3.207 . . . . 0.0 112.266 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.74 135.39 40.33 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.766 0.826 . . . . 0.0 111.038 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.77 45.13 6.14 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 125.326 1.441 . . . . 0.0 113.163 168.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.7 m -138.84 38.61 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 125.874 1.67 . . . . 0.0 109.392 173.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -65.47 -15.96 63.17 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -148.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -148.27 17.14 1.06 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 127.572 2.349 . . . . 0.0 111.344 175.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.46 ' CG ' ' HB2' ' A' ' 85' ' ' LYS . 3.4 m-85 -61.6 152.66 29.97 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 122.017 0.913 . . . . 0.0 109.358 177.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m -75.01 153.97 38.24 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 126.32 1.848 . . . . 0.0 108.706 165.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 33.9 p90 -137.36 163.62 30.58 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.39 1.076 . . . . 0.0 110.69 167.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.4 mt -141.83 133.05 26.35 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 127.422 2.289 . . . . 0.0 106.726 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.8 p -159.05 159.63 2.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.349 1.06 . . . . 0.0 108.672 -175.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -86.93 146.85 26.0 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 119.095 0.861 . . . . 0.0 109.905 177.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.28 -10.69 11.71 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 126.676 1.991 . . . . 0.0 114.024 176.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -136.36 -6.95 2.0 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 125.678 1.591 . . . . 0.0 113.395 -169.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -130.14 37.61 3.88 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 125.931 1.692 . . . . 0.0 107.512 179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.18 -39.3 28.85 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.332 0.653 . . . . 0.0 111.531 -173.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -90.1 -7.15 54.48 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.594 1.157 . . . . 0.0 112.574 -174.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.62 -65.86 1.39 Allowed Glycine 0 C--N 1.334 0.461 0 C-N-CA 124.426 1.012 . . . . 0.0 111.895 -167.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.99 128.04 33.57 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 -171.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.0 tt -137.58 149.36 25.45 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 45.4 mt -133.64 138.11 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 172.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -111.06 152.24 27.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 126.298 1.839 . . . . 0.0 106.828 172.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -154.11 163.43 40.11 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 121.171 -0.955 . . . . 0.0 108.821 171.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.46 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -146.94 109.81 4.68 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 173.426 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -77.06 82.36 3.57 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.417 1.087 . . . . 0.0 108.702 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -74.14 179.53 4.39 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.232 2.213 . . . . 0.0 109.32 172.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.84 117.48 6.68 Favored Glycine 0 CA--C 1.531 1.042 0 O-C-N 120.533 -1.354 . . . . 0.0 112.127 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 53.68 11.45 0.31 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.582 2.353 . . . . 0.0 114.267 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.3 m -143.78 159.33 42.7 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 120.288 1.404 . . . . 0.0 109.151 -166.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.0 t -133.82 116.73 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 167.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 2.5 mp -84.36 102.6 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 168.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.45 134.39 27.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 175.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -134.18 97.98 4.0 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.755 1.622 . . . . 0.0 108.465 -175.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 40.9 p90 -122.57 168.49 12.1 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.612 -1.305 . . . . 0.0 110.554 -172.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.9 t -153.1 167.24 29.9 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.509 1.124 . . . . 0.0 109.045 -173.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.5 p -88.77 -15.25 35.14 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.501 0.72 . . . . 0.0 112.422 166.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -150.53 147.03 26.98 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.541 0.736 . . . . 0.0 110.683 -170.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.33 11.2 0.09 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.366 1.866 . . . . 0.0 113.546 176.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.44 10.13 3.19 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 117.219 2.304 . . . . 0.0 117.219 -177.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -116.33 158.74 22.95 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.152 0.501 . . . . 0.0 110.509 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.15 131.02 42.94 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 -175.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -64.3 146.32 54.58 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.294 0.569 . . . . 0.0 110.065 -177.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -59.69 172.1 0.77 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.168 0.987 . . . . 0.0 109.936 163.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -130.23 108.24 9.88 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.188 0.995 . . . . 0.0 108.445 168.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -116.96 85.09 2.26 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 104.17 -2.53 . . . . 0.0 104.17 172.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -79.73 137.77 37.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 171.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.6 mt -143.9 147.79 34.5 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.86 149.77 39.44 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 118.432 0.56 . . . . 0.0 110.554 171.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.43 -38.07 71.07 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.658 0.783 . . . . 0.0 110.528 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.3 t -55.37 -42.59 74.14 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.794 177.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -56.59 19.49 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 123.495 0.718 . . . . 0.0 110.189 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.0 mt -55.0 -39.97 69.63 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 122.771 0.429 . . . . 0.0 111.206 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -69.95 -37.97 75.99 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.795 0.438 . . . . 0.0 110.915 -178.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -29.29 64.23 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.565 1.146 . . . . 0.0 111.156 177.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -88.83 -42.86 11.63 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 118.045 -0.978 . . . . 0.0 112.174 -169.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -133.14 14.89 4.21 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.895 0.771 . . . . 0.0 112.754 -176.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -135.83 26.95 3.32 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.637 -1.289 . . . . 0.0 112.892 177.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -93.2 -21.52 19.59 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 126.774 2.03 . . . . 0.0 113.28 -174.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.9 p -87.61 -167.74 1.99 Allowed 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 118.912 0.778 . . . . 0.0 110.324 -175.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 15.5 mmp_? -103.38 -43.31 5.46 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.72 0.808 . . . . 0.0 110.169 161.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.15 -22.65 67.02 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -175.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -65.08 -24.89 67.58 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 120.355 1.434 . . . . 0.0 110.981 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -65.9 -7.45 16.64 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 121.458 -0.776 . . . . 0.0 111.938 174.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.91 -75.86 0.24 Allowed 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 157.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -55.17 -55.6 29.38 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 113.736 1.014 . . . . 0.0 113.736 -166.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 57.8 t -58.83 -54.08 38.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 124.569 1.148 . . . . 0.0 109.754 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.27 -26.1 67.54 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -74.25 -42.56 59.46 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 125.036 1.335 . . . . 0.0 110.393 176.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -57.25 -41.7 80.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.252 0.621 . . . . 0.0 110.205 172.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 25.7 t -70.88 -30.12 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 O-C-N 121.175 -0.953 . . . . 0.0 111.126 177.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -77.54 -15.56 59.19 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.762 0.825 . . . . 0.0 112.596 175.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -105.92 7.2 41.22 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.919 1.723 . . . . 0.0 112.376 -172.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.91 146.69 27.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.563 1.182 . . . . 0.0 110.054 -172.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 12.7 mtt-85 -111.54 155.45 23.27 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 126.98 2.112 . . . . 0.0 109.427 -173.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.3 m -131.51 23.56 4.74 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 122.145 0.974 . . . . 0.0 110.744 -176.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 . . . . . 0 C--O 1.251 1.16 0 C-N-CA 128.696 2.799 . . . . 0.0 112.243 161.161 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 . . . . . 0 CA--C 1.534 0.347 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.68 ' HG1' ' NE2' ' A' ' 26' ' ' GLN . 32.8 p -135.6 166.97 21.99 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 177.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -57.44 -36.79 71.83 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.844 0.458 . . . . 0.0 110.618 -176.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.68 ' NE2' ' HG1' ' A' ' 24' ' ' THR . 0.0 OUTLIER -62.75 -49.5 74.77 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.92 1.288 . . . . 0.0 110.858 178.091 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -58.56 -39.77 81.2 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.204 1.002 . . . . 0.0 109.69 -175.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 85.9 mt -72.17 -36.49 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 C-N-CA 124.856 1.262 . . . . 0.0 109.809 -176.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -57.01 -33.72 64.53 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 123.653 0.644 . . . . 0.0 112.813 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.06 -55.8 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 118.146 0.973 . . . . 0.0 109.193 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.92 -42.22 75.75 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.98 0.912 . . . . 0.0 111.772 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.45 -51.05 69.88 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.35 1.86 . . . . 0.0 110.799 173.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.52 -25.65 75.3 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 123.264 0.459 . . . . 0.0 112.678 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 74.2 mt -67.49 -20.29 65.44 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 119.575 1.688 . . . . 0.0 112.412 176.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -81.48 -17.39 48.82 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.637 -0.664 . . . . 0.0 112.702 169.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.9 mm -142.95 101.1 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 N-CA-C 106.519 -1.659 . . . . 0.0 106.519 -158.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.2 m 55.8 54.47 9.07 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 123.295 0.638 . . . . 0.0 112.599 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.64 -40.64 44.92 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.121 2.548 . . . . 0.0 111.028 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -65.43 -47.78 75.04 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.774 -0.579 . . . . 0.0 110.29 -170.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -48.23 -45.88 34.75 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.61 1.964 . . . . 0.0 110.396 170.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.16 -46.29 74.47 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -166.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -62.91 -37.73 88.15 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 117.05 -1.452 . . . . 0.0 111.552 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -59.22 -48.43 81.65 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 120.231 1.378 . . . . 0.0 108.989 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -64.9 -40.93 95.86 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 118.433 -0.794 . . . . 0.0 111.001 -172.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.9 mm -63.72 -44.81 98.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 119.284 0.947 . . . . 0.0 110.556 173.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.94 -11.25 26.64 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -116.51 7.6 13.77 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.297 1.439 . . . . 0.0 112.008 174.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 46.12 34.38 2.07 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.295 2.638 . . . . 0.0 112.969 -175.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -82.66 -13.54 56.26 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.7 1.6 . . . . 0.0 113.863 -177.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.6 tp -93.71 123.62 37.17 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.584 -0.698 . . . . 0.0 110.228 -156.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 79.0 t -104.36 140.71 21.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 124.541 1.136 . . . . 0.0 108.176 173.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -108.36 151.35 26.13 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 129.141 2.976 . . . . 0.0 106.841 169.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -165.4 173.9 41.17 Favored Glycine 0 N--CA 1.451 -0.306 0 O-C-N 121.517 -0.74 . . . . 0.0 111.658 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -107.8 143.37 18.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 163.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.2 t -48.5 -60.82 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 125.73 1.612 . . . . 0.0 113.703 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.2 mttt 60.63 165.92 0.09 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.866 1.666 . . . . 0.0 113.262 -170.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -72.7 -7.43 20.78 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.14 1.894 . . . . 0.0 112.514 171.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 m -70.04 -34.85 73.77 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.584 0.754 . . . . 0.0 112.437 -177.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -107.17 167.59 9.8 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 119.005 0.82 . . . . 0.0 112.163 -160.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.9 m -89.17 103.82 16.41 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.071 0.948 . . . . 0.0 109.555 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 28.9 m -140.45 156.58 69.47 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 123.602 0.761 . . . . 0.0 111.899 -164.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -71.84 179.28 4.93 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.649 2.233 . . . . 0.0 110.149 172.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.9 162.76 27.84 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.741 0.816 . . . . 0.0 110.228 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.8 13.56 82.99 Favored Glycine 0 CA--C 1.529 0.918 0 CA-C-O 118.907 -0.941 . . . . 0.0 113.376 171.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.7 m -146.38 75.03 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 C-N-CA 125.685 1.594 . . . . 0.0 108.956 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.53 -15.29 33.28 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 119.964 -1.71 . . . . 0.0 113.183 173.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -150.81 5.72 0.51 Allowed 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 125.528 1.531 . . . . 0.0 110.933 -161.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -69.42 144.33 53.37 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 167.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.5 m -71.01 163.26 27.94 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.309 163.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -142.46 166.95 23.26 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.994 0.918 . . . . 0.0 111.118 169.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 20.4 mt -142.15 134.48 27.83 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 127.338 2.255 . . . . 0.0 107.55 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.6 p -160.95 157.64 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 125.992 1.717 . . . . 0.0 106.648 -171.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.0 157.39 31.22 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.022 -1.049 . . . . 0.0 109.022 167.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.07 -11.35 60.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 118.149 -0.929 . . . . 0.0 112.78 169.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -136.49 21.74 3.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.623 1.569 . . . . 0.0 110.896 -171.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -140.71 43.98 1.83 Allowed 'General case' 0 N--CA 1.471 0.624 0 O-C-N 120.321 -1.487 . . . . 0.0 107.785 172.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.89 -48.33 80.96 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.1 -1.0 . . . . 0.0 110.654 -172.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -76.05 -3.67 37.1 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.48 -98.21 0.8 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.162 0.887 . . . . 0.0 112.166 -173.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 19.4 m -104.79 151.06 24.23 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.487 -1.008 . . . . 0.0 109.405 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.8 tt -153.83 154.41 7.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-N 119.256 0.934 . . . . 0.0 109.339 165.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 53.6 mt -130.25 127.05 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 171.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -102.67 155.79 18.07 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.03 1.332 . . . . 0.0 107.919 168.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 7.0 p90 -161.15 153.89 20.77 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 120.913 -1.117 . . . . 0.0 109.757 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.0 tttt -142.38 119.96 11.76 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 172.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.48 140.66 32.19 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.036 0.835 . . . . 0.0 109.077 169.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -134.72 84.09 2.08 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.212 1.805 . . . . 0.0 108.075 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 73.63 -49.06 1.63 Allowed Glycine 0 CA--C 1.529 0.956 0 C-N-CA 125.969 1.747 . . . . 0.0 113.237 175.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -142.06 -43.51 0.34 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.96 2.104 . . . . 0.0 110.308 166.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 4.4 m -78.75 126.21 30.41 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 120.226 -1.546 . . . . 0.0 109.719 -165.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 23.8 t -105.65 113.39 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.1 mp -83.32 95.19 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 169.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.5 mt -76.55 117.51 21.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 172.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -113.08 83.7 1.87 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.467 1.907 . . . . 0.0 107.865 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -102.3 166.91 10.31 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 120.396 -1.44 . . . . 0.0 110.837 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 13.7 t -136.06 177.88 7.49 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 169.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.8 p -128.31 -3.07 5.6 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 126.228 1.811 . . . . 0.0 110.683 171.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -147.24 142.46 27.24 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 157.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 39.1 mmm-85 -57.74 -34.26 69.33 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.504 0.721 . . . . 0.0 112.834 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.76 13.6 0.62 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -179.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.0 p -132.92 158.89 41.47 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 119.482 1.037 . . . . 0.0 110.401 171.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.54 174.24 1.04 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-O 122.253 1.025 . . . . 0.0 110.968 171.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -83.66 149.57 26.43 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.653 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -177.39 0.39 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.224 1.81 . . . . 0.0 108.35 156.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -154.14 94.6 1.75 Allowed 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.006 -1.059 . . . . 0.0 111.558 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.7 tptt -101.43 119.98 39.59 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 173.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -114.44 123.42 49.39 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.922 1.289 . . . . 0.0 109.014 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 24.7 mt -142.84 141.42 31.59 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.322 1.049 . . . . 0.0 109.299 -168.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 p -78.78 148.71 32.85 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 120.411 1.459 . . . . 0.0 111.62 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 9.7 mt -56.44 -30.82 63.32 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 120.855 -1.153 . . . . 0.0 111.937 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -46.92 77.46 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 124.257 1.023 . . . . 0.0 110.981 177.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -55.07 -59.56 4.59 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.575 -1.202 . . . . 0.0 108.99 168.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -48.09 -45.21 32.4 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.423 1.01 . . . . 0.0 111.538 -176.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -69.96 -30.94 68.42 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.47 0.708 . . . . 0.0 111.834 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -65.89 0.63 Allowed 'General case' 0 C--N 1.323 -0.548 0 O-C-N 120.758 -1.214 . . . . 0.0 107.873 169.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -44.54 -51.61 8.75 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.535 2.334 . . . . 0.0 110.311 -172.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -125.18 13.25 8.32 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.132 0.973 . . . . 0.0 111.932 -166.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.44 15.52 3.19 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 119.985 1.266 . . . . 0.0 112.375 172.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.545 ' N ' HE21 ' A' ' 123' ' ' GLN 0.261 0.2 OUTLIER -62.11 -45.12 94.87 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 178.725 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.35 -176.11 2.13 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 119.934 1.243 . . . . 0.0 110.579 -164.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -25.02 39.16 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 119.197 -2.189 . . . . 0.0 111.29 170.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.35 -22.13 28.6 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 125.139 1.376 . . . . 0.0 109.563 -166.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.545 HE21 ' N ' ' A' ' 119' ' ' GLN . 2.3 mm-40 -54.94 -33.53 62.35 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.994 0.918 . . . . 0.0 110.644 173.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.84 -3.42 2.43 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.968 1.707 . . . . 0.0 113.109 178.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.06 -2.41 2.56 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 128.35 2.66 . . . . 0.0 111.903 -175.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -112.08 -70.18 0.82 Allowed 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 124.974 1.309 . . . . 0.0 108.174 174.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.6 t -49.33 -58.26 1.43 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 C-N-CA 124.915 1.286 . . . . 0.0 108.901 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -18.46 58.17 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -179.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -85.08 -43.23 14.08 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 125.84 1.656 . . . . 0.0 111.275 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -62.93 -34.49 77.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.25 0.62 . . . . 0.0 110.298 177.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 17.2 t -66.04 -16.73 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.051 -1.031 . . . . 0.0 111.167 173.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -106.58 2.48 26.1 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.408 1.483 . . . . 0.0 111.902 176.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -114.56 -6.68 19.33 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.474 1.035 . . . . 0.0 112.692 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -80.05 169.9 17.2 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.541 1.17 . . . . 0.0 110.229 173.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -124.5 162.56 23.72 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.635 1.974 . . . . 0.0 106.898 175.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.4 m -132.75 11.18 4.36 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.581 0.628 . . . . 0.0 111.807 -175.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 C--O 1.252 1.207 0 C-N-CA 124.208 1.003 . . . . 0.0 108.404 -157.321 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.695 ' HG1' ' NE2' ' A' ' 26' ' ' GLN . 3.1 p -88.13 159.87 18.02 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 173.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -48.54 -47.8 39.01 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.864 0.866 . . . . 0.0 110.488 173.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.695 ' NE2' ' HG1' ' A' ' 24' ' ' THR . 0.1 OUTLIER -54.47 -55.08 32.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.867 0.867 . . . . 0.0 110.374 -179.08 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -58.97 -43.87 91.43 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.734 1.613 . . . . 0.0 110.396 -173.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 85.1 mt -60.89 -45.27 98.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 125.521 1.528 . . . . 0.0 108.592 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -61.74 -35.12 90.76 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 124.206 0.907 . . . . 0.0 112.908 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.4 t -66.23 -51.8 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.107 0 CA-C-N 118.161 0.981 . . . . 0.0 108.634 177.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.35 -40.52 97.51 Favored 'General case' 0 CA--C 1.522 -0.097 0 O-C-N 121.947 -0.471 . . . . 0.0 111.661 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.17 -34.56 76.65 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.469 -0.3 . . . . 0.0 110.576 175.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.22 -28.65 57.8 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.16 -27.08 69.12 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.059 1.429 . . . . 0.0 111.247 170.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.13 -21.67 59.77 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.118 -0.988 . . . . 0.0 111.939 174.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -131.07 91.92 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 125.558 1.543 . . . . 0.0 108.755 -171.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.18 67.5 0.92 Allowed Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.426 1.49 . . . . 0.0 110.041 -178.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -64.25 -33.19 60.72 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.716 2.277 . . . . 0.0 111.528 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -65.16 -48.02 74.99 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 117.56 -1.209 . . . . 0.0 110.32 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -48.7 -61.49 2.01 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.651 0.78 . . . . 0.0 109.912 168.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -45.45 -58.27 3.48 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.137 1.775 . . . . 0.0 109.94 -177.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -63.07 -44.58 95.4 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.787 1.235 . . . . 0.0 111.651 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -62.06 -32.88 73.45 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 119.372 0.987 . . . . 0.0 111.08 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -65.59 -50.34 65.46 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 41.8 mm -60.18 -36.59 69.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 118.518 0.599 . . . . 0.0 111.203 177.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.34 -12.42 21.0 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 118.675 0.67 . . . . 0.0 112.693 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.62 19.8 7.28 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.204 1.802 . . . . 0.0 111.761 172.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 51.71 23.77 2.13 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 127.747 2.419 . . . . 0.0 113.164 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -78.68 -26.45 45.0 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.785 1.234 . . . . 0.0 113.624 -165.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.81 145.11 38.67 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.473 1.509 . . . . 0.0 109.69 -157.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 22.0 t -124.31 158.39 31.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 126.453 1.901 . . . . 0.0 108.612 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -124.14 143.11 50.67 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 127.055 2.142 . . . . 0.0 106.571 165.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -149.15 163.97 29.22 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 110.252 -1.139 . . . . 0.0 110.252 169.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 20.1 mm -93.29 144.21 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 105.281 -2.118 . . . . 0.0 105.281 157.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 28.1 t -45.18 -68.13 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 126.454 1.902 . . . . 0.0 112.394 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.7 mttt 59.76 150.75 0.09 OUTLIER Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 130.342 3.457 . . . . 0.0 113.178 -165.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -77.74 -16.35 14.72 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.172 1.915 . . . . 0.0 113.335 -170.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -69.25 -3.59 14.4 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.35 -0.844 . . . . 0.0 112.84 175.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -115.55 172.59 7.02 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.574 1.55 . . . . 0.0 108.593 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.9 m -108.9 123.94 49.86 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 -168.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -142.64 155.82 63.36 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.025 0.93 . . . . 0.0 111.374 -170.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -65.93 172.99 7.63 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.563 2.842 . . . . 0.0 111.171 164.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.15 139.81 44.76 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 121.323 -0.861 . . . . 0.0 111.861 -178.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.54 54.45 3.72 Favored Glycine 0 CA--C 1.488 -1.638 0 C-N-CA 126.201 1.858 . . . . 0.0 113.848 172.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.6 p 176.35 71.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 -169.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.9 -16.12 13.93 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.599 1.159 . . . . 0.0 111.27 176.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -145.2 12.71 1.39 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.406 2.282 . . . . 0.0 110.321 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.436 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 4.1 m-85 -62.21 147.42 47.89 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 168.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.4 m -71.9 159.94 33.4 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 163.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -140.55 155.84 46.48 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.4 1.08 . . . . 0.0 109.982 165.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -117.9 133.76 55.61 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 167.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.6 p -149.83 164.94 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.884 1.674 . . . . 0.0 106.783 169.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.31 149.66 22.38 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 119.982 1.264 . . . . 0.0 108.381 171.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.82 -18.69 64.37 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -172.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -136.04 26.43 3.27 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.535 2.334 . . . . 0.0 109.024 -175.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -128.88 39.22 3.83 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 128.138 2.575 . . . . 0.0 105.417 159.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -67.41 -50.3 60.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 127.159 2.184 . . . . 0.0 110.778 -161.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -96.84 39.88 1.16 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.539 1.536 . . . . 0.0 107.664 167.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -116.59 -126.08 3.82 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 126.247 1.879 . . . . 0.0 110.146 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.53 136.18 33.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 117.427 0.614 . . . . 0.0 109.976 -172.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.1 tt -140.19 151.09 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-O 121.585 0.707 . . . . 0.0 109.782 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.8 mt -134.9 108.72 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -77.08 152.98 34.79 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.155 0.889 . . . . 0.0 109.552 167.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.0 p90 -152.86 164.91 36.98 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.313 -1.492 . . . . 0.0 109.825 166.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -148.55 138.04 21.99 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 158.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -74.98 151.24 38.83 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 162.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -138.46 13.54 2.77 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.342 1.857 . . . . 0.0 111.444 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 103.5 100.84 2.61 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 108.79 -1.724 . . . . 0.0 108.79 -178.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 49.6 12.92 0.07 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.576 1.95 . . . . 0.0 115.097 -171.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.68 148.37 39.0 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.892 1.277 . . . . 0.0 107.688 -174.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 60.1 t -135.45 114.72 16.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 125.377 1.471 . . . . 0.0 107.743 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -79.38 101.23 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 167.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mt -79.65 113.11 18.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 169.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.436 ' HD2' ' CE2' ' A' ' 68' ' ' TYR . 13.0 mttt -109.76 100.41 9.42 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -178.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 43.6 p90 -124.7 174.18 8.05 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 121.548 -0.72 . . . . 0.0 110.869 -171.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.5 t -169.42 164.72 10.64 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -173.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -13.38 60.52 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.076 0.95 . . . . 0.0 112.896 166.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -135.56 -170.6 2.64 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.12 0.968 . . . . 0.0 110.754 -162.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.52 -70.38 0.8 Allowed 'General case' 0 CA--C 1.503 -0.839 0 C-N-CA 125.48 1.512 . . . . 0.0 109.798 -173.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -77.23 51.31 0.83 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.644 0.778 . . . . 0.0 112.554 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.1 p -141.81 165.51 27.28 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 119.734 -1.854 . . . . 0.0 111.283 176.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.04 161.55 24.14 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.599 -0.688 . . . . 0.0 110.734 174.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -114.42 160.43 19.18 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.877 1.271 . . . . 0.0 109.966 -163.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -73.96 177.16 5.82 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.511 0.724 . . . . 0.0 109.217 162.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.02 51.4 1.31 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.304 1.041 . . . . 0.0 112.043 -171.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . 0.43 ' HE3' HD23 ' A' ' 108' ' ' LEU . 31.3 tptt -65.56 120.14 12.37 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 106.314 -1.735 . . . . 0.0 106.314 173.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -122.18 93.12 3.89 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 119.883 1.22 . . . . 0.0 108.361 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.43 HD23 ' HE3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -95.92 159.75 14.81 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 123.941 0.896 . . . . 0.0 108.722 178.296 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.616 ' HG1' ' NE2' ' A' ' 112' ' ' GLN . 68.6 p -73.96 155.2 38.89 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.625 167.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 28.3 mt -57.57 -39.12 76.02 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 120.361 -1.462 . . . . 0.0 109.405 166.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 t -63.54 -34.12 77.09 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 124.139 0.976 . . . . 0.0 111.195 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.616 ' NE2' ' HG1' ' A' ' 109' ' ' THR . 0.0 OUTLIER -54.66 -69.18 0.13 Allowed 'General case' 0 C--N 1.345 0.391 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 168.569 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -53.66 -35.26 60.83 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.255 0.622 . . . . 0.0 112.407 -169.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 7.9 tmtm? -62.28 -58.23 8.49 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 118.082 0.401 . . . . 0.0 110.695 173.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.87 -30.48 70.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.703 -170.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.3 -85.36 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.809 2.444 . . . . 0.0 108.023 170.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -90.03 -16.02 30.62 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -161.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -115.06 45.39 1.63 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.146 0.979 . . . . 0.0 110.156 -167.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.421 ' NE2' ' H ' ' A' ' 119' ' ' GLN . 0.0 OUTLIER -81.72 -37.48 27.24 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -164.542 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . 0.314 0.1 OUTLIER -101.17 -164.42 1.11 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.375 1.07 . . . . 0.0 109.968 -173.195 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.92 -22.47 16.3 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.959 1.704 . . . . 0.0 111.971 162.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 35.7 p -80.42 -31.17 37.67 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 117.619 -1.182 . . . . 0.0 110.841 -173.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -61.44 -30.09 70.36 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.397 1.453 . . . . 0.0 110.771 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 12.2 mtpt -52.8 -34.81 55.33 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 118.838 -0.601 . . . . 0.0 109.731 -178.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.47 -26.33 65.16 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.119 -0.943 . . . . 0.0 112.806 -178.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -99.86 -51.61 3.67 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 118.495 0.589 . . . . 0.0 110.065 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.3 t -59.26 -48.44 86.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 O-C-N 121.703 -0.623 . . . . 0.0 110.368 -174.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -61.98 -36.96 83.05 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 121.81 -0.556 . . . . 0.0 111.794 175.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -62.32 -42.8 99.68 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.223 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -58.91 -39.35 81.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.211 1.005 . . . . 0.0 110.306 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 97.8 t -68.95 -33.08 57.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 O-C-N 121.694 -0.629 . . . . 0.0 111.236 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -86.38 -16.28 37.8 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.128 0.877 . . . . 0.0 111.712 174.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.39 -46.29 6.56 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 125.72 1.629 . . . . 0.0 110.787 -178.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.1 pp -55.29 142.44 31.84 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.45 0.643 . . . . 0.0 109.805 176.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.26 171.68 11.73 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.801 1.641 . . . . 0.0 110.103 172.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.76 -5.48 11.57 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.876 0.87 . . . . 0.0 111.782 171.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 . . . . . 0 C--O 1.24 0.567 0 C-N-CA 130.919 3.688 . . . . 0.0 107.098 175.435 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 CA--C 1.538 0.512 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 p -126.53 149.27 49.48 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.251 1.42 . . . . 0.0 107.666 164.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -66.11 -23.89 66.59 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.602 1.161 . . . . 0.0 111.424 -169.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -56.65 -48.88 76.58 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.284 2.233 . . . . 0.0 109.798 170.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -67.72 -36.02 79.84 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.726 1.61 . . . . 0.0 110.742 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 97.6 mt -69.8 -42.84 80.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 C-N-CA 123.975 0.91 . . . . 0.0 111.037 -172.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -65.06 -29.93 76.65 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 119.062 0.847 . . . . 0.0 112.152 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.6 t -62.65 -56.73 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 171.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.4 mp -56.58 -40.36 75.11 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.706 0.802 . . . . 0.0 112.169 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.54 69.69 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.9 0.773 . . . . 0.0 111.069 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.05 -21.88 79.5 Favored Glycine 0 CA--C 1.533 1.168 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 mp -66.06 -22.45 66.42 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 120.268 -1.725 . . . . 0.0 112.116 170.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.85 -18.43 32.88 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.103 -0.951 . . . . 0.0 113.078 173.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -132.71 94.99 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -176.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 59.33 70.52 1.09 Allowed Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 126.698 1.999 . . . . 0.0 111.741 -174.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -56.94 -45.42 36.35 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 122.206 1.937 . . . . 0.0 110.584 173.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.43 -46.21 80.37 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.63 0.772 . . . . 0.0 112.091 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -57.18 -49.33 76.31 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 119.04 0.836 . . . . 0.0 109.559 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.0 tt -55.15 -58.2 8.65 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.8 mtpt -55.48 -39.97 71.09 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.544 1.138 . . . . 0.0 110.97 -174.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -67.6 -48.33 67.11 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 118.317 0.508 . . . . 0.0 111.019 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -66.26 -29.24 69.44 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.818 -176.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.4 mm -64.61 -45.39 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 119.706 1.139 . . . . 0.0 109.764 169.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.83 -10.06 34.53 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.972 -1.08 . . . . 0.0 112.759 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.86 -4.7 25.83 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.334 1.453 . . . . 0.0 112.991 171.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 46.1 39.8 6.36 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.329 1.452 . . . . 0.0 110.496 -167.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.68 -13.44 15.57 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.303 1.441 . . . . 0.0 112.373 -177.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.8 134.52 34.31 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.036 0.934 . . . . 0.0 108.93 -167.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.6 t -117.23 164.79 13.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 125.704 1.602 . . . . 0.0 109.232 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -144.21 110.56 5.51 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 129.698 3.199 . . . . 0.0 103.214 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.51 170.8 24.6 Favored Glycine 0 CA--C 1.518 0.253 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 170.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 42.2 mm -99.96 143.53 13.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -175.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -51.18 -60.43 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 C-N-CA 124.98 1.312 . . . . 0.0 111.538 174.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.5 mttt 60.14 165.69 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 125.361 1.464 . . . . 0.0 113.909 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -63.92 -25.83 67.02 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.865 1.71 . . . . 0.0 112.743 170.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 30.4 m -86.75 2.7 47.85 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -164.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -125.14 160.78 28.33 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 119.69 1.132 . . . . 0.0 110.548 -170.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.0 m -89.3 114.89 26.33 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.655 0.782 . . . . 0.0 109.101 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 6.0 m -143.04 165.24 27.16 Favored Pre-proline 0 C--O 1.237 0.436 0 O-C-N 121.369 -0.832 . . . . 0.0 112.428 -170.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -66.89 165.0 27.49 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.136 2.557 . . . . 0.0 111.495 168.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.49 137.92 54.81 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 121.835 -0.54 . . . . 0.0 110.562 174.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.0 25.22 11.55 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-O 118.756 -1.024 . . . . 0.0 114.783 161.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.6 m -136.54 29.58 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 124.515 1.126 . . . . 0.0 110.883 -174.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -58.16 -16.27 12.83 Favored 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 117.584 2.439 . . . . 0.0 117.584 -153.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -156.2 32.56 0.33 Allowed 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 127.465 2.306 . . . . 0.0 108.985 172.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -69.4 155.91 39.68 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 167.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.67 153.8 36.94 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 161.058 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -136.81 149.49 47.78 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.724 0.809 . . . . 0.0 109.828 164.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.91 127.17 54.78 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 175.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -145.56 159.6 12.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 171.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.84 159.43 19.71 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 169.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.86 -18.78 57.98 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -122.95 7.69 9.29 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.75 1.62 . . . . 0.0 112.539 -173.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -110.38 21.18 16.98 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.0 0.92 . . . . 0.0 111.16 -174.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -49.08 -44.32 41.88 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 128.054 2.542 . . . . 0.0 113.096 -167.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -103.57 -8.81 19.75 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.967 0.907 . . . . 0.0 111.948 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.3 -69.36 1.4 Allowed Glycine 0 C--N 1.334 0.467 0 C-N-CA 125.73 1.633 . . . . 0.0 110.36 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.59 161.83 36.96 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.895 0.847 . . . . 0.0 110.815 -170.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tt -163.18 152.23 3.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 171.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.7 mt -133.36 143.67 38.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 168.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -118.5 149.91 40.5 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.826 1.651 . . . . 0.0 108.194 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -147.35 159.99 43.04 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.047 1.294 . . . . 0.0 111.87 171.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.0 tttm -154.85 110.59 3.14 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.173 0.589 . . . . 0.0 110.692 167.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.42 108.73 2.06 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 127.992 2.517 . . . . 0.0 112.87 172.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -121.45 97.58 5.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.726 1.21 . . . . 0.0 111.345 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 48.92 77.43 0.12 Allowed Glycine 0 CA--C 1.522 0.509 0 C-N-CA 124.317 0.961 . . . . 0.0 113.199 174.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 68.43 -86.56 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.503 1.921 . . . . 0.0 107.906 -155.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.2 m -64.11 131.63 48.08 Favored 'General case' 0 C--N 1.314 -0.962 0 C-N-CA 125.043 1.337 . . . . 0.0 113.769 -157.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 2.8 m -101.05 114.6 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 O-C-N 121.089 -1.007 . . . . 0.0 111.424 -179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.3 mp -72.6 100.59 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 172.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 16.8 mt -81.08 139.76 17.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 167.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -129.7 112.53 13.74 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.273 1.429 . . . . 0.0 107.484 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.3 p90 -137.55 167.43 21.68 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 120.854 -1.154 . . . . 0.0 110.533 -168.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -153.48 170.86 19.71 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.681 0.753 . . . . 0.0 109.258 -173.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.88 0.6 13.8 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.257 1.023 . . . . 0.0 110.827 169.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -143.87 153.45 42.35 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 124.108 0.963 . . . . 0.0 111.557 168.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -77.78 1.96 18.58 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 121.421 -0.8 . . . . 0.0 112.409 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.58 1.45 14.27 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.038 1.495 . . . . 0.0 115.038 -174.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.6 p -120.04 173.09 7.29 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.722 0.809 . . . . 0.0 112.544 -165.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.7 tptt -71.26 132.1 44.45 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.597 0.759 . . . . 0.0 109.924 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -64.18 132.29 49.96 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.243 0.544 . . . . 0.0 109.562 170.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -67.1 175.43 2.59 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 125.358 1.463 . . . . 0.0 109.425 164.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -124.48 153.07 42.56 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.895 1.278 . . . . 0.0 110.007 176.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -165.3 109.63 0.87 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 127.567 2.347 . . . . 0.0 104.773 168.021 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.05 121.5 39.01 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 115.412 -2.232 . . . . 0.0 108.073 -171.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -119.64 121.97 40.48 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 122.869 2.577 . . . . 0.0 110.782 -171.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.9 p -59.17 143.97 47.3 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.299 0.571 . . . . 0.0 109.946 176.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 29.3 mt -52.31 -31.58 33.69 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.612 -1.305 . . . . 0.0 112.166 171.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.1 t -64.05 -43.36 95.72 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 117.169 -1.396 . . . . 0.0 111.819 174.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -51.88 -65.58 0.53 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-N 119.57 1.077 . . . . 0.0 109.512 173.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -56.9 -34.23 67.7 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.354 0.525 . . . . 0.0 111.647 -169.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 ttmp? -70.71 -40.16 73.0 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 118.689 -0.672 . . . . 0.0 110.53 -177.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -59.15 3.95 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 173.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -47.46 -50.81 22.09 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 124.184 0.928 . . . . 0.0 111.978 -173.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -130.55 14.65 5.47 Favored 'General case' 0 C--O 1.226 -0.182 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -165.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -149.69 22.83 0.9 Allowed 'General case' 0 C--O 1.239 0.54 0 O-C-N 120.521 -1.362 . . . . 0.0 113.157 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.51 -29.04 58.13 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.094 1.758 . . . . 0.0 113.846 -176.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 9.6 t -135.7 159.9 40.19 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.069 1.348 . . . . 0.0 111.052 -169.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -71.08 -33.02 69.81 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.867 176.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.57 -37.83 88.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 119.686 1.13 . . . . 0.0 109.918 -176.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -63.27 -19.27 64.42 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.661 1.185 . . . . 0.0 112.955 175.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -55.72 -32.91 63.76 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 117.836 -1.078 . . . . 0.0 111.298 174.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -54.21 -59.19 5.0 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 124.039 0.837 . . . . 0.0 110.469 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.07 -47.04 39.29 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 123.35 0.66 . . . . 0.0 110.455 -168.211 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 58.1 t -56.4 -56.53 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -59.35 -31.09 68.88 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 118.529 -0.748 . . . . 0.0 113.014 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -67.68 -37.57 82.51 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 119.064 0.847 . . . . 0.0 111.187 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -61.64 -42.46 98.93 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.611 0.641 . . . . 0.0 109.595 171.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 15.4 t -63.1 -38.89 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 121.445 -0.784 . . . . 0.0 110.517 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -81.14 -18.87 44.9 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.824 0.85 . . . . 0.0 112.535 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -108.27 -5.59 32.31 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 125.531 1.539 . . . . 0.0 114.103 -177.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.6 pp -78.08 146.09 35.42 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 118.764 1.282 . . . . 0.0 108.953 170.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 2.7 mtp-105 -90.38 165.01 14.1 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 124.149 0.98 . . . . 0.0 108.978 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.0 m -121.69 6.07 9.99 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.696 0.798 . . . . 0.0 111.203 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . 0.331 7.8 pt-20 . . . . . 0 C--O 1.247 0.921 0 C-N-CA 129.47 3.108 . . . . 0.0 113.177 -162.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.615 ' HG1' ' NE2' ' A' ' 26' ' ' GLN . 10.3 p -93.57 165.58 12.67 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -56.36 -44.26 79.96 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.968 0.804 . . . . 0.0 110.211 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.615 ' NE2' ' HG1' ' A' ' 24' ' ' THR . 0.0 OUTLIER -57.36 -50.64 72.32 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.57 0.748 . . . . 0.0 110.03 179.536 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -59.01 -48.38 81.8 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.564 1.145 . . . . 0.0 109.708 -175.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.2 mt -65.5 -35.91 76.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -175.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -57.83 -36.6 80.62 Favored Glycine 0 C--N 1.338 0.654 0 CA-C-O 118.967 -0.907 . . . . 0.0 112.712 177.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 75.6 t -70.13 -46.45 72.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 118.176 0.988 . . . . 0.0 109.157 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.1 mp -60.15 -46.31 90.09 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.398 1.079 . . . . 0.0 111.508 177.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.99 -48.66 64.31 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.676 1.19 . . . . 0.0 110.515 175.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.07 -30.36 77.53 Favored Glycine 0 C--N 1.337 0.623 0 CA-C-O 119.15 -0.806 . . . . 0.0 113.619 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.3 mt -63.77 -22.59 66.98 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 119.698 1.749 . . . . 0.0 112.408 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -94.56 -16.39 23.3 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 118.526 -0.75 . . . . 0.0 112.272 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -126.59 94.64 2.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.0 65.88 2.22 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 125.417 1.487 . . . . 0.0 111.865 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.38 -44.17 48.65 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.067 2.511 . . . . 0.0 111.891 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -66.9 -38.74 86.81 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.971 0.908 . . . . 0.0 110.251 -173.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 75.7 t90 -55.66 -56.31 21.94 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.7 tt -54.86 -52.3 63.22 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.867 -0.52 . . . . 0.0 110.785 -178.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.7 mttm -56.24 -47.7 77.96 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.655 0.782 . . . . 0.0 111.65 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -66.07 -38.48 88.4 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 118.937 0.79 . . . . 0.0 110.15 -177.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -69.12 -42.04 76.58 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.648 0.658 . . . . 0.0 110.62 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 25.4 mm -57.62 -40.29 74.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 119.203 0.911 . . . . 0.0 110.645 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.86 -20.08 55.02 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -119.96 23.25 11.13 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 120.949 -1.095 . . . . 0.0 112.117 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.4 t30 45.18 35.41 1.7 Allowed 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.967 2.107 . . . . 0.0 110.748 -176.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -79.52 -12.66 59.86 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 121.28 -0.887 . . . . 0.0 109.799 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -107.77 123.55 48.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 119.144 0.884 . . . . 0.0 108.863 -156.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.5 p -111.11 142.98 21.9 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 C-N-CA 124.565 1.146 . . . . 0.0 109.427 -178.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -99.0 137.78 37.04 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 126.065 1.746 . . . . 0.0 106.703 163.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.06 178.64 30.83 Favored Glycine 0 CA--C 1.522 0.494 0 CA-C-N 119.349 0.977 . . . . 0.0 110.944 176.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 18.4 mm -115.07 146.59 19.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 125.557 1.543 . . . . 0.0 107.371 172.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.2 t -54.11 -75.49 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.253 1.273 0 C-N-CA 126.067 1.747 . . . . 0.0 110.935 171.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp 54.33 158.23 0.06 OUTLIER Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 129.291 3.036 . . . . 0.0 112.06 -156.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -70.87 -4.9 15.7 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 122.334 2.023 . . . . 0.0 111.526 167.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.4 m -67.98 3.55 1.52 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.53 1.932 . . . . 0.0 113.409 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -136.32 173.55 11.59 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.271 1.396 . . . . 0.0 110.668 -173.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 m -90.11 104.12 16.73 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.255 1.822 . . . . 0.0 108.118 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.0 m -150.44 154.39 35.66 Favored Pre-proline 0 C--O 1.238 0.488 0 O-C-N 121.894 -0.504 . . . . 0.0 111.625 -168.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.21 166.42 26.96 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.684 2.256 . . . . 0.0 110.954 175.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -76.79 146.93 37.55 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.477 0.711 . . . . 0.0 110.482 -174.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.01 32.53 44.16 Favored Glycine 0 CA--C 1.528 0.858 0 O-C-N 121.693 -0.629 . . . . 0.0 113.976 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.9 m -133.63 26.12 1.15 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-N 118.787 1.294 . . . . 0.0 109.806 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -61.05 -16.16 40.54 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -154.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -143.81 14.88 1.74 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 127.337 2.255 . . . . 0.0 111.516 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -66.27 146.29 54.78 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.52 161.98 29.76 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.159 163.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 21.4 p90 -135.55 172.25 13.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 125.23 1.412 . . . . 0.0 109.604 165.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.9 mt -130.91 135.84 48.04 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 106.181 -1.785 . . . . 0.0 106.181 168.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.7 p -149.19 152.64 11.82 Favored 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-N 120.431 1.469 . . . . 0.0 110.766 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.86 112.39 15.98 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 172.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.16 -9.66 18.14 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 129.565 3.146 . . . . 0.0 114.735 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -106.55 -39.33 5.89 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.478 0.711 . . . . 0.0 109.733 169.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -94.55 51.01 1.38 Allowed 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 -171.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -67.82 -2.67 7.63 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -166.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -124.45 14.35 8.86 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.194 1.798 . . . . 0.0 111.459 166.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -80.23 -88.09 0.55 Allowed Glycine 0 N--CA 1.448 -0.531 0 O-C-N 120.835 -1.165 . . . . 0.0 111.194 175.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.3 m -130.69 160.86 33.04 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 123.799 0.84 . . . . 0.0 109.291 -170.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.8 tt -154.25 153.79 7.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 169.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.7 mt -139.73 112.21 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 119.017 0.826 . . . . 0.0 109.503 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -86.34 154.7 21.02 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.22 0.918 . . . . 0.0 110.987 177.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.7 p90 -163.06 155.59 18.66 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.995 0.918 . . . . 0.0 109.682 172.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.7 tttt -143.25 113.45 7.27 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 123.976 0.91 . . . . 0.0 108.568 167.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -84.81 95.91 9.13 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -66.01 -2.69 4.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.371 0.669 . . . . 0.0 112.385 179.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 91.62 127.64 4.01 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 107.45 -2.26 . . . . 0.0 107.45 -178.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 52.9 -12.82 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.473 1.909 . . . . 0.0 115.364 -162.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 59.9 m -144.37 156.81 44.4 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 122.346 2.339 . . . . 0.0 109.604 175.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.9 p -146.89 106.95 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 C-N-CA 124.892 1.277 . . . . 0.0 111.442 -175.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -78.47 108.27 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 176.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 27.0 mt -95.49 126.01 48.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 125.339 1.456 . . . . 0.0 108.258 174.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -123.81 101.73 7.43 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 126.071 1.749 . . . . 0.0 106.709 -173.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 27.6 p90 -116.96 166.49 12.12 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.161 -0.962 . . . . 0.0 111.746 -176.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -147.88 169.08 20.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.094 1.358 . . . . 0.0 109.339 173.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.7 p -108.98 -2.67 18.08 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.046 2.539 . . . . 0.0 111.171 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -135.38 131.8 36.78 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 124.407 1.083 . . . . 0.0 108.871 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -23.89 40.48 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -97.78 -0.03 46.03 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 116.354 1.983 . . . . 0.0 116.354 -167.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.7 p -116.48 167.16 11.3 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -165.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -72.5 152.96 41.6 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.486 -0.759 . . . . 0.0 109.408 176.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -87.9 162.75 16.74 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.77 0.828 . . . . 0.0 111.567 -167.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -73.44 -173.85 1.51 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.882 1.673 . . . . 0.0 108.989 166.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.0 93.91 2.56 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.081 0.952 . . . . 0.0 111.053 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.9 tptt -103.2 150.3 23.82 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 163.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -140.88 125.82 18.23 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 115.708 -2.091 . . . . 0.0 107.159 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -121.8 158.63 28.44 Favored 'General case' 0 CA--C 1.499 -1.015 0 CA-C-N 122.114 2.233 . . . . 0.0 108.316 -177.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.422 ' HG1' ' NE2' ' A' ' 112' ' ' GLN . 68.7 p -74.08 156.56 37.31 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 119.891 1.223 . . . . 0.0 109.365 166.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 34.5 mt -59.33 -36.1 75.06 Favored 'General case' 0 C--N 1.34 0.154 0 O-C-N 121.441 -0.787 . . . . 0.0 110.079 167.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.86 -36.44 82.32 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.799 -177.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . 0.422 ' NE2' ' HG1' ' A' ' 109' ' ' THR . 0.0 OUTLIER -51.31 -59.05 4.64 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 124.062 0.945 . . . . 0.0 109.137 171.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -56.14 -40.03 73.17 Favored 'General case' 0 C--N 1.339 0.125 0 C-N-CA 123.09 0.556 . . . . 0.0 112.071 -175.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -63.58 -45.35 90.81 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 121.784 -0.573 . . . . 0.0 110.009 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -35.06 74.45 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.242 -0.409 . . . . 0.0 110.436 -177.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.46 -58.84 4.03 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.373 0.669 . . . . 0.0 109.241 177.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -134.26 19.17 3.7 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -161.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -141.01 66.34 1.37 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.268 1.395 . . . . 0.0 112.867 171.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -119.32 -25.54 6.07 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 -167.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.2 t -139.66 152.59 46.86 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 120.423 1.465 . . . . 0.0 108.644 -172.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -58.85 -30.51 67.76 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 119.916 -1.74 . . . . 0.0 113.202 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 65.5 m -53.05 -48.3 67.77 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 118.637 -0.697 . . . . 0.0 110.388 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.38 -33.03 64.81 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 117.169 -1.812 . . . . 0.0 107.88 -178.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 35.2 mtpt -62.94 -3.39 1.6 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 114.22 1.193 . . . . 0.0 114.22 174.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -76.55 -81.89 0.08 Allowed 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 105.35 -2.093 . . . . 0.0 105.35 155.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.64 -49.57 76.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -163.193 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . 0.474 ' HA ' ' CD2' ' A' ' 130' ' ' TYR . 38.3 t -56.86 -38.24 58.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 125.346 1.458 . . . . 0.0 110.722 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.62 -32.88 47.66 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.396 -0.815 . . . . 0.0 110.871 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -69.15 -31.38 70.0 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 120.899 -1.125 . . . . 0.0 111.461 175.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.474 ' CD2' ' HA ' ' A' ' 127' ' ' VAL . 14.7 m-85 -63.06 -24.68 68.02 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 120.496 -1.378 . . . . 0.0 111.237 172.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 40.3 t -78.19 -11.99 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 122.942 0.497 . . . . 0.0 110.445 174.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -104.71 -17.01 14.79 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.423 1.089 . . . . 0.0 111.972 172.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -96.91 17.94 58.39 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 125.762 1.648 . . . . 0.0 113.026 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.0 pp -106.45 149.08 27.41 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 122.18 0.99 . . . . 0.0 110.275 177.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.1 mtt-85 -75.61 169.33 18.32 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.185 2.194 . . . . 0.0 107.83 163.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.22 -3.84 2.42 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.328 1.051 . . . . 0.0 113.014 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 C--O 1.245 0.847 0 C-N-CA 131.162 3.785 . . . . 0.0 107.145 177.196 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 . . . . . 0 CA--C 1.55 0.958 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -141.2 144.68 34.9 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 129.223 3.009 . . . . 0.0 106.438 174.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -53.01 -43.57 66.6 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 120.174 1.352 . . . . 0.0 110.531 -174.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.13 -54.22 7.09 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.065 1.746 . . . . 0.0 110.942 174.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.8 mm-40 -68.35 -36.9 79.93 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.675 1.19 . . . . 0.0 111.496 -177.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 97.9 mt -71.8 -39.92 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.066 0 C-N-CA 123.632 0.773 . . . . 0.0 109.39 -173.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.13 -35.55 92.13 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-N 118.828 0.74 . . . . 0.0 112.199 -175.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.6 -45.33 98.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 118.303 1.051 . . . . 0.0 109.534 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.62 -38.47 90.35 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.981 0.912 . . . . 0.0 110.711 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.95 -41.03 83.11 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.707 0.803 . . . . 0.0 111.188 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.71 -33.44 71.35 Favored Glycine 0 CA--C 1.528 0.87 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 176.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.57 -30.25 71.39 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 120.639 -1.507 . . . . 0.0 111.38 172.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.31 64.43 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 117.683 -1.151 . . . . 0.0 112.189 172.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -135.56 96.71 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 C-N-CA 125.375 1.47 . . . . 0.0 107.885 -165.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 60.98 67.41 1.46 Allowed Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.524 1.13 . . . . 0.0 109.762 -177.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -60.29 -33.88 94.18 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.734 2.289 . . . . 0.0 110.866 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -70.37 -39.64 74.48 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.66 -0.65 . . . . 0.0 111.955 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.1 t90 -56.97 -53.23 60.42 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.131 0.878 . . . . 0.0 108.859 174.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -46.4 -57.14 4.93 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.437 1.495 . . . . 0.0 109.329 173.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.1 mtpt -61.68 -41.08 97.08 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.464 1.106 . . . . 0.0 112.27 -175.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -67.55 -48.09 67.97 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.46 1.027 . . . . 0.0 109.562 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -42.03 81.05 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.801 0.441 . . . . 0.0 110.2 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.2 mm -60.52 -54.9 28.74 Favored 'Isoleucine or valine' 0 C--N 1.341 0.236 0 C-N-CA 124.438 1.095 . . . . 0.0 110.132 174.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.75 -42.85 65.33 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.352 0.661 . . . . 0.0 110.691 -175.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.23 -8.44 53.61 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 50.34 40.66 23.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.946 1.698 . . . . 0.0 110.979 -165.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -111.64 -5.57 14.48 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.871 0.868 . . . . 0.0 113.337 178.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.0 tp -73.63 128.7 36.21 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 119.172 0.896 . . . . 0.0 109.643 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.8 t -113.54 150.18 15.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 169.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -120.02 149.18 42.58 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 128.067 2.547 . . . . 0.0 106.908 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -163.7 177.21 39.64 Favored Glycine 0 N--CA 1.45 -0.413 0 N-CA-C 111.581 -0.607 . . . . 0.0 111.581 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.6 mm -106.45 149.24 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 125.375 1.47 . . . . 0.0 107.055 168.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -52.4 -86.02 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-O 116.866 -1.54 . . . . 0.0 110.627 172.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt 55.44 164.99 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.925 0 CA-C-N 120.408 1.458 . . . . 0.0 112.956 -167.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -84.12 -3.36 10.29 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.36 2.707 . . . . 0.0 114.632 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.5 m -59.36 -24.16 63.16 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.369 1.068 . . . . 0.0 113.409 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.16 165.75 17.68 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 128.982 2.913 . . . . 0.0 108.103 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.4 t -65.64 146.69 54.5 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 121.781 -0.574 . . . . 0.0 109.568 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 1.9 m -153.55 162.36 26.82 Favored Pre-proline 0 C--O 1.237 0.413 0 C-N-CA 125.73 1.612 . . . . 0.0 108.865 174.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -75.71 167.82 25.59 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.798 2.332 . . . . 0.0 110.423 171.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.68 139.81 51.32 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 123.62 0.768 . . . . 0.0 109.996 171.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.54 39.45 5.01 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 125.797 1.665 . . . . 0.0 112.842 169.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.3 m -152.2 27.79 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 125.454 1.501 . . . . 0.0 111.143 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -65.75 -16.19 63.54 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -151.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -153.07 52.06 0.74 Allowed 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 128.547 2.739 . . . . 0.0 106.542 169.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -89.46 154.89 19.68 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 164.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.63 162.14 28.51 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 164.201 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -141.3 170.76 15.12 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.539 1.136 . . . . 0.0 109.757 166.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 18.7 mt -141.22 138.66 33.46 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 126.461 1.904 . . . . 0.0 107.176 174.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.8 p -162.4 155.82 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 125.636 1.574 . . . . 0.0 107.571 177.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.04 158.18 30.7 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 119.724 1.147 . . . . 0.0 108.97 170.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.26 -21.23 66.11 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 177.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' A' ' 77' ' ' GLN . 24.7 m-20 -100.01 -32.01 11.17 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.11 0.964 . . . . 0.0 111.305 176.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.08 13.84 0.19 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.551 2.341 . . . . 0.0 112.076 -178.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . 0.439 ' NE2' HH22 ' A' ' 99' ' ' ARG . 17.9 mm100 -59.5 -12.33 6.13 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.95 1.7 . . . . 0.0 113.793 -171.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.59 -2.83 9.36 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.923 0.889 . . . . 0.0 112.119 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.02 -87.92 1.72 Allowed Glycine 0 CA--C 1.526 0.764 0 C-N-CA 124.405 1.002 . . . . 0.0 112.483 -174.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 m -103.62 166.96 10.1 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.709 1.204 . . . . 0.0 109.298 -174.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.3 tt -166.65 151.24 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 124.64 1.176 . . . . 0.0 107.983 165.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.9 mt -134.6 99.19 2.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -78.6 153.04 31.46 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -157.9 158.96 36.04 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.491 -0.755 . . . . 0.0 109.333 167.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.02 106.89 4.66 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 167.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -82.69 147.61 28.39 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 168.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -147.57 -153.74 0.51 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 126.127 1.771 . . . . 0.0 107.911 -167.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.93 88.89 0.01 OUTLIER Glycine 0 CA--C 1.527 0.795 0 C-N-CA 125.815 1.674 . . . . 0.0 111.432 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 53.88 8.72 0.17 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.554 2.342 . . . . 0.0 115.491 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.6 m -125.35 163.48 22.49 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.554 1.942 . . . . 0.0 108.124 -175.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 7.7 p -151.19 106.37 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -0.99 0 C-N-CA 125.158 1.383 . . . . 0.0 111.865 174.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -74.41 96.65 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 172.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 15.3 mt -77.8 127.56 38.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 105.991 -1.855 . . . . 0.0 105.991 163.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -127.11 97.14 4.83 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 125.389 1.475 . . . . 0.0 107.343 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -124.03 167.6 13.97 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.018 -1.051 . . . . 0.0 109.69 -173.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . 0.3 9.8 t -131.68 -163.71 1.36 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.83 0.824 . . . . 0.0 109.557 -166.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 p -122.59 -1.63 9.0 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 120.874 -1.141 . . . . 0.0 111.209 152.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -153.48 145.44 23.62 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 124.606 1.163 . . . . 0.0 111.697 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.439 HH22 ' NE2' ' A' ' 77' ' ' GLN . 11.1 mmt180 -52.13 -33.75 41.35 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 167.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -79.71 -5.22 54.79 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 -173.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -133.11 163.93 28.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -168.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.491 ' HD2' ' H ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -69.45 164.02 24.0 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.553 1.168 . . . . 0.0 111.452 -164.866 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.491 ' H ' ' HD2' ' A' ' 102' ' ' LYS . 1.3 mm? -94.9 138.3 32.83 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.99 -1.005 . . . . 0.0 108.707 -174.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 7.8 mptt -60.38 169.18 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.627 1.171 . . . . 0.0 109.86 161.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -127.07 90.62 3.18 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.765 1.226 . . . . 0.0 109.849 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.71 83.66 1.88 Allowed 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 171.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.43 138.65 47.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 117.241 -1.361 . . . . 0.0 107.334 168.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.0 mt -133.79 -177.45 4.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 120.693 1.588 . . . . 0.0 106.795 171.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 62.1 p -101.13 155.73 17.83 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.666 0.746 . . . . 0.0 110.467 172.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 21.7 mt -59.83 -16.67 30.32 Favored 'General case' 0 C--O 1.237 0.435 0 O-C-N 121.641 -0.662 . . . . 0.0 112.238 166.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.16 -50.95 10.18 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 117.561 -1.209 . . . . 0.0 109.5 172.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -44.95 -61.27 1.68 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 124.403 1.081 . . . . 0.0 109.517 176.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.4 -36.93 74.31 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.214 0.916 . . . . 0.0 112.052 -168.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -65.2 -45.01 86.54 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.522 -0.736 . . . . 0.0 110.417 173.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.27 -2.01 26.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.868 2.067 . . . . 0.0 113.505 177.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -105.95 -46.57 4.07 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.067 1.747 . . . . 0.0 109.69 179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -139.16 16.9 2.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.373 1.069 . . . . 0.0 113.248 -166.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -139.68 14.86 2.52 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 120.862 -1.149 . . . . 0.0 113.331 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.573 ' NE2' HE22 ' A' ' 123' ' ' GLN . 2.2 pm0 -58.2 -64.15 1.02 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 9.6 p -73.37 179.56 3.92 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.914 0.779 . . . . 0.0 111.286 -168.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 36.2 mtt85 -81.51 -55.85 4.41 Favored 'General case' 0 CA--C 1.507 -0.696 0 O-C-N 121.46 -0.775 . . . . 0.0 111.642 170.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 11.5 m -66.13 -26.99 67.7 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.191 -168.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.573 HE22 ' NE2' ' A' ' 119' ' ' GLN . 12.9 tt0 -55.64 -37.77 68.64 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.159 0.584 . . . . 0.0 111.015 173.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.4 mtpt -62.2 -28.43 69.67 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 118.157 -0.925 . . . . 0.0 110.71 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -63.86 -51.76 63.15 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.89 -57.31 9.15 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 123.6 0.76 . . . . 0.0 110.978 178.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 65.9 t -51.23 -51.14 24.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -73.78 -24.83 59.89 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.8 0.727 . . . . 0.0 112.555 -176.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -61.04 -48.02 83.67 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.926 0.89 . . . . 0.0 109.274 166.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 7.7 m-30 -61.28 -41.02 96.25 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.875 0.87 . . . . 0.0 109.719 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.0 t -64.17 -22.56 31.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 O-C-N 121.14 -0.975 . . . . 0.0 110.837 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -104.08 -13.94 16.09 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 119.842 1.201 . . . . 0.0 113.075 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.98 -27.17 58.85 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 124.459 1.028 . . . . 0.0 110.686 174.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.5 pp -73.42 147.29 44.37 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 118.3 1.05 . . . . 0.0 110.282 175.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -105.83 167.03 10.06 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.474 1.51 . . . . 0.0 107.785 -177.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.7 m -126.34 3.06 7.02 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.438 1.017 . . . . 0.0 111.431 175.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.149 0 C-N-CA 127.509 2.324 . . . . 0.0 107.181 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 . . . . . 0 CA--C 1.543 0.705 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.0 p -141.52 153.49 44.92 Favored 'General case' 0 N--CA 1.463 0.209 0 O-C-N 120.46 -1.4 . . . . 0.0 111.245 -177.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -61.21 -39.0 88.58 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.494 0.717 . . . . 0.0 110.846 -167.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -49.88 70.68 Favored 'General case' 0 C--N 1.341 0.196 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -177.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 60.9 mm-40 -60.81 -47.44 86.35 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.998 1.319 . . . . 0.0 109.29 -177.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 84.5 mt -61.34 -38.5 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 123.433 0.693 . . . . 0.0 110.242 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.64 -19.67 73.26 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 119.136 -0.813 . . . . 0.0 113.636 -178.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.9 t -70.53 -52.66 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 170.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.83 -36.29 83.44 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 122.297 -0.252 . . . . 0.0 110.755 -176.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.63 -49.67 69.98 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.424 0.69 . . . . 0.0 111.622 171.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.93 -34.3 88.14 Favored Glycine 0 CA--C 1.529 0.935 0 CA-C-O 119.56 -0.578 . . . . 0.0 111.726 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.19 -27.51 68.74 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.412 1.606 . . . . 0.0 112.041 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.36 -14.56 60.08 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.089 -1.007 . . . . 0.0 112.653 172.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.2 mm -136.43 89.65 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 124.947 1.299 . . . . 0.0 107.583 -167.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.65 60.49 1.42 Allowed Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.652 1.181 . . . . 0.0 110.376 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -58.28 -33.86 98.07 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.286 2.658 . . . . 0.0 112.511 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.61 -34.71 78.9 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.083 0.553 . . . . 0.0 111.762 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -64.94 -55.92 16.3 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 175.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.2 tt -49.15 -50.3 38.29 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.903 0.481 . . . . 0.0 110.055 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -55.56 -54.23 46.58 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.439 1.096 . . . . 0.0 112.041 177.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -56.82 -42.18 79.14 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.675 0.671 . . . . 0.0 111.689 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -65.02 -53.04 52.3 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.334 1.053 . . . . 0.0 109.992 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 mm -58.61 -40.88 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 C-N-CA 124.555 1.142 . . . . 0.0 109.78 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.17 -8.44 17.12 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.648 0.779 . . . . 0.0 112.802 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -121.36 5.86 10.18 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.013 1.725 . . . . 0.0 111.87 175.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 44.95 33.16 0.95 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.516 1.927 . . . . 0.0 111.825 -168.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -98.96 43.48 1.06 Allowed 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 176.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -134.52 142.46 47.02 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.572 1.078 . . . . 0.0 108.284 172.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.8 p -126.53 165.84 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 C-N-CA 126.651 1.98 . . . . 0.0 110.579 175.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -131.62 120.19 22.49 Favored 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 103.232 -2.877 . . . . 0.0 103.232 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -135.46 -178.98 16.11 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mm -122.39 144.54 31.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 C-N-CA 125.631 1.572 . . . . 0.0 107.545 172.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.7 t -45.85 -75.19 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 C-N-CA 128.481 2.713 . . . . 0.0 111.958 174.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp 57.3 166.61 0.07 OUTLIER Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 119.543 1.065 . . . . 0.0 111.326 -166.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.07 -4.06 13.61 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.29 1.993 . . . . 0.0 112.299 -178.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.7 p -58.31 -78.86 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 128.673 2.789 . . . . 0.0 111.808 -171.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.47 153.38 28.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.31 121.09 16.18 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.051 1.34 . . . . 0.0 109.048 -169.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.1 m -135.36 160.92 66.18 Favored Pre-proline 0 C--O 1.24 0.601 0 C-N-CA 123.962 0.905 . . . . 0.0 110.241 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.46 171.37 13.1 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.335 2.023 . . . . 0.0 110.603 170.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.37 151.4 34.88 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.425 171.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.9 47.82 11.02 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 124.653 1.121 . . . . 0.0 111.122 174.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.6 m -151.4 26.28 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 125.796 1.638 . . . . 0.0 110.15 170.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -61.75 -16.9 53.4 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.577 2.066 . . . . 0.0 116.577 -151.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -144.71 14.34 1.55 Allowed 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 128.082 2.553 . . . . 0.0 111.445 -172.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -70.69 149.47 46.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.186 1.395 . . . . 0.0 109.666 -179.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.2 m -73.25 164.28 26.9 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.892 163.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -142.19 158.36 43.83 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.218 1.007 . . . . 0.0 109.947 166.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.71 136.29 54.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.577 1.551 . . . . 0.0 107.96 170.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.1 p -152.4 155.48 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-N 119.454 1.024 . . . . 0.0 109.524 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -90.1 121.77 32.46 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 120.109 1.322 . . . . 0.0 109.186 176.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.43 -10.16 41.17 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -166.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -117.39 2.89 12.52 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.838 1.255 . . . . 0.0 110.903 -178.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -135.55 38.53 2.87 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 128.86 2.864 . . . . 0.0 106.902 -179.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -64.74 -12.88 51.91 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 120.653 -1.279 . . . . 0.0 113.271 -163.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -107.83 3.81 24.79 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 127.94 2.496 . . . . 0.0 112.346 177.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.36 -78.37 0.98 Allowed Glycine 0 C--N 1.336 0.535 0 N-CA-C 110.239 -1.144 . . . . 0.0 110.239 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 20.7 m -121.64 156.81 32.21 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.463 1.105 . . . . 0.0 109.817 -174.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.4 tt -152.39 152.88 10.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.525 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 163.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 80.4 mt -133.59 117.79 28.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 172.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -84.17 153.87 23.42 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 170.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.7 p90 -155.34 162.85 40.73 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 120.924 -1.11 . . . . 0.0 110.265 165.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -145.12 129.11 17.48 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 117.971 0.35 . . . . 0.0 111.031 162.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.32 118.65 14.38 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.707 0.803 . . . . 0.0 109.865 164.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -131.23 76.01 1.69 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.752 2.421 . . . . 0.0 106.138 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.16 -129.46 9.68 Favored Glycine 0 C--N 1.338 0.686 0 C-N-CA 124.684 1.135 . . . . 0.0 112.142 174.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -88.45 22.29 2.59 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.107 1.453 . . . . 0.0 112.129 170.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 93.9 m -137.16 148.37 46.55 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.945 1.698 . . . . 0.0 108.082 176.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 61.5 t -118.76 129.03 75.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 167.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 19.8 mm -91.39 108.32 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 105.009 -2.219 . . . . 0.0 105.009 169.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.8 mt -89.85 141.96 13.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 173.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -136.34 100.43 4.38 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 125.473 1.509 . . . . 0.0 108.17 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 34.9 p90 -115.6 165.89 12.52 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 122.75 0.42 . . . . 0.0 111.034 -174.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.2 t -146.51 171.76 14.58 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 125.801 1.64 . . . . 0.0 107.573 172.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 53.0 p -106.45 19.7 20.11 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.399 1.479 . . . . 0.0 110.253 169.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -127.91 -171.46 2.45 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.775 0.83 . . . . 0.0 109.217 167.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.71 -25.56 23.4 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 169.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -142.65 15.76 1.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -149.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.9 p -119.03 -179.92 3.97 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 119.754 1.161 . . . . 0.0 113.762 -170.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -53.22 125.4 17.43 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 123.666 0.786 . . . . 0.0 110.099 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 58.6 mt -79.61 159.56 26.74 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 125.59 1.556 . . . . 0.0 109.043 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -82.08 177.4 8.84 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 125.162 1.385 . . . . 0.0 110.162 171.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.37 119.76 35.57 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.256 1.422 . . . . 0.0 109.948 171.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.3 tptt -144.83 132.62 21.17 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 170.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -138.85 105.45 5.33 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 106.195 -1.779 . . . . 0.0 106.195 -171.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -118.22 145.44 44.99 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -174.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 37.4 p -75.02 153.05 38.66 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.332 0.515 . . . . 0.0 111.917 176.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.3 mt -60.5 -23.94 64.92 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 121.814 -0.554 . . . . 0.0 110.515 168.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.94 -46.41 71.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.321 172.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -51.41 -65.39 0.56 Allowed 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.462 1.105 . . . . 0.0 110.304 176.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.74 -34.87 73.51 Favored 'General case' 0 CA--C 1.521 -0.137 0 C-N-CA 122.781 0.432 . . . . 0.0 111.878 -170.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -69.74 -34.03 73.27 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.906 -0.496 . . . . 0.0 109.834 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -53.92 12.29 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.982 174.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -53.43 -56.74 14.37 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.14 0.976 . . . . 0.0 110.706 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -124.09 11.62 8.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.167 0.987 . . . . 0.0 113.171 -160.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -143.99 23.46 1.7 Allowed 'General case' 0 CA--C 1.537 0.454 0 O-C-N 120.525 -1.359 . . . . 0.0 114.475 175.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.615 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -69.53 -40.29 76.99 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 120.27 -1.519 . . . . 0.0 114.418 -171.445 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.8 t -107.05 173.57 6.27 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 126.369 1.868 . . . . 0.0 109.048 -163.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 2.2 mtm-85 -79.65 -47.85 14.71 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 124.104 0.961 . . . . 0.0 112.593 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.0 m -57.42 -37.61 73.03 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.731 0.645 . . . . 0.0 110.519 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.615 HE22 ' NE2' ' A' ' 119' ' ' GLN . 15.1 tt0 -62.33 -29.79 70.7 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.454 -0.779 . . . . 0.0 111.796 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 29.4 mtpt -65.68 -33.49 76.01 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 118.047 -0.977 . . . . 0.0 109.801 -178.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -49.38 78.04 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 176.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -69.63 -56.84 6.14 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 118.633 -0.698 . . . . 0.0 110.202 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 53.5 t -49.32 -53.31 9.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 123.882 0.873 . . . . 0.0 110.826 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -71.59 -17.56 62.28 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.731 0.696 . . . . 0.0 112.043 -177.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -80.7 -29.94 36.44 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.24 -0.912 . . . . 0.0 111.126 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -64.37 -36.64 84.79 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 167.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 26.1 t -64.68 -23.47 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 121.04 -1.038 . . . . 0.0 110.653 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -89.73 15.32 9.87 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.782 -1.199 . . . . 0.0 112.25 174.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -136.23 9.31 4.12 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 124.693 1.139 . . . . 0.0 114.258 -174.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.2 22.88 11.93 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -161.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 19.2 mtt180 44.26 -164.04 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 130.675 3.59 . . . . 0.0 110.773 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.36 -5.12 0.39 Allowed 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 118.892 -1.123 . . . . 0.0 112.685 159.115 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 . . . . . 0 C--O 1.254 1.322 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 -173.016 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 . . . . . 0 CA--C 1.534 0.328 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.545 ' HG1' ' NE2' ' A' ' 26' ' ' GLN . 22.0 p -120.26 170.68 9.11 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 165.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -62.65 -43.53 98.58 Favored 'General case' 0 C--O 1.233 0.22 0 O-C-N 121.743 -0.598 . . . . 0.0 110.078 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.545 ' NE2' ' HG1' ' A' ' 24' ' ' THR . 0.0 OUTLIER -60.38 -48.83 80.06 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 123.987 0.915 . . . . 0.0 109.977 179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.8 mm-40 -55.55 -47.36 76.46 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 125.49 1.516 . . . . 0.0 110.391 -175.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.4 mt -64.15 -33.41 62.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -178.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -65.88 -30.84 77.95 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-O 118.957 -0.913 . . . . 0.0 113.871 178.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.6 t -75.89 -44.75 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mp -55.42 -45.46 76.75 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.008 0.523 . . . . 0.0 110.449 173.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.46 -42.46 96.21 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.942 0.497 . . . . 0.0 111.672 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.33 -20.75 79.55 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 112.115 -0.394 . . . . 0.0 112.115 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.6 mp -69.77 -26.87 64.5 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.985 -1.303 . . . . 0.0 111.803 173.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.88 -27.56 36.26 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 171.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.3 mp -127.08 95.18 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -174.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m 67.51 63.5 0.73 Allowed Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.398 1.479 . . . . 0.0 113.009 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.94 -42.4 37.56 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.243 2.628 . . . . 0.0 111.721 176.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.12 -42.71 75.7 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.408 -0.807 . . . . 0.0 110.563 -173.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . 0.412 ' HA ' ' HG2' ' A' ' 43' ' ' GLN . 37.6 t90 -60.04 -37.58 80.21 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.087 0.555 . . . . 0.0 111.604 175.01 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.31 -63.32 1.34 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 172.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -55.13 -36.83 66.17 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 123.585 0.754 . . . . 0.0 112.286 -173.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.412 ' HG2' ' HA ' ' A' ' 40' ' ' TRP 0.252 1.5 pt20 -64.59 -45.15 88.2 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 118.193 0.452 . . . . 0.0 111.166 -176.32 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -69.06 -34.16 74.73 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 124.157 0.983 . . . . 0.0 110.616 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.7 mm -58.87 -45.18 91.82 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.494 166.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.03 -4.3 4.54 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -177.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.57 10.08 7.19 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.276 1.03 . . . . 0.0 111.658 170.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 49.14 31.29 3.42 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.439 2.295 . . . . 0.0 113.111 -173.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -91.13 3.37 54.95 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.196 1.799 . . . . 0.0 115.657 -174.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.5 tp -87.47 139.53 30.45 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.099 1.318 . . . . 0.0 110.758 -177.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 71.8 t -114.33 123.62 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 C-N-CA 124.856 1.263 . . . . 0.0 107.69 165.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -71.93 135.16 46.4 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.269 1.428 . . . . 0.0 107.791 156.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -147.24 167.59 28.44 Favored Glycine 0 C--N 1.333 0.406 0 CA-C-N 118.633 0.652 . . . . 0.0 112.281 175.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 20.0 mm -117.49 134.38 61.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 106.153 -1.795 . . . . 0.0 106.153 173.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 28.8 t -47.91 -71.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 C-N-CA 128.194 2.597 . . . . 0.0 110.089 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 21.2 mttt 58.65 159.03 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.517 0 C-N-CA 127.115 2.166 . . . . 0.0 113.276 -166.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.69 -12.32 30.95 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 121.872 1.715 . . . . 0.0 111.732 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -60.87 -14.18 20.43 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.214 1.405 . . . . 0.0 112.509 175.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -131.38 -173.53 3.14 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 120.237 1.381 . . . . 0.0 112.264 -173.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 24.6 m -129.2 101.69 6.13 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.744 1.218 . . . . 0.0 107.803 -149.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.9 m -142.96 157.19 61.49 Favored Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 124.977 1.311 . . . . 0.0 110.859 -154.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -67.24 172.04 10.63 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 122.279 1.986 . . . . 0.0 111.573 175.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.52 141.33 57.91 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.775 0.83 . . . . 0.0 111.366 176.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.61 43.16 45.0 Favored Glycine 0 CA--C 1.485 -1.791 0 C-N-CA 124.299 0.952 . . . . 0.0 113.234 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.252 1.6 p -170.37 80.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.416 -2.135 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 177.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -98.82 -6.64 28.82 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.015 -1.448 . . . . 0.0 112.235 162.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -152.4 -1.64 0.27 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -168.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -67.92 115.66 7.69 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 119.657 1.117 . . . . 0.0 108.343 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -53.8 139.16 33.98 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.777 1.231 . . . . 0.0 109.948 -177.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 22.3 p90 -122.38 167.15 13.64 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.353 0.661 . . . . 0.0 112.665 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.0 mt -143.22 125.71 15.77 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 127.336 2.254 . . . . 0.0 106.47 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.6 p -157.39 155.52 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 125.144 1.378 . . . . 0.0 108.397 -178.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.87 157.17 16.92 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.416 1.007 . . . . 0.0 110.422 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.01 -25.62 63.82 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 -166.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -106.71 -8.65 16.77 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 124.549 1.14 . . . . 0.0 112.339 -174.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.6 p30 -123.48 32.55 5.6 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.905 0.882 . . . . 0.0 109.233 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -51.72 -22.42 3.5 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.197 0.999 . . . . 0.0 113.556 173.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -116.47 6.43 13.57 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.77 1.628 . . . . 0.0 112.877 175.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.82 -126.13 1.75 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 126.39 1.948 . . . . 0.0 110.553 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.0 m -64.2 160.1 19.24 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 170.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.2 tt -157.46 147.8 10.24 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 160.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 88.9 mt -126.99 135.46 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -119.61 157.14 29.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 126.012 1.725 . . . . 0.0 106.983 176.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -159.72 153.81 23.4 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 120.425 -1.422 . . . . 0.0 108.906 172.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.79 110.68 13.36 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 166.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.74 84.32 0.9 Allowed 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 161.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -75.96 -169.53 1.14 Allowed 'General case' 0 C--O 1.24 0.555 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.62 104.56 0.39 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 124.19 0.9 . . . . 0.0 111.007 178.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 62.55 14.72 7.3 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.323 1.449 . . . . 0.0 111.614 168.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.0 m -144.44 138.96 28.06 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.571 1.948 . . . . 0.0 107.985 -172.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 18.5 t -115.38 112.03 38.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 169.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.2 mp -86.64 104.12 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 N-CA-C 105.726 -1.953 . . . . 0.0 105.726 166.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 mt -86.54 113.78 24.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -108.4 98.7 8.19 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 126.32 1.848 . . . . 0.0 108.63 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -124.25 165.89 16.85 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 119.925 -1.735 . . . . 0.0 110.533 -175.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.5 t -154.22 171.27 19.47 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.635 1.574 . . . . 0.0 108.774 -177.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.5 -11.74 19.07 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.651 1.58 . . . . 0.0 111.288 174.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -147.6 145.51 29.03 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.15 176.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.0 tpt85 -53.8 -41.35 67.2 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.139 0.976 . . . . 0.0 109.796 173.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . 0.416 HD21 ' C ' ' A' ' 100' ' ' ASN . 0.1 OUTLIER -78.56 26.68 0.22 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.489 1.515 . . . . 0.0 114.94 176.382 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.95 158.6 43.9 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 119.753 -1.842 . . . . 0.0 112.131 172.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.4 tptm -63.29 166.68 6.02 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 124.397 1.079 . . . . 0.0 109.616 169.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 26.5 mt -105.88 156.52 18.27 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 125.822 1.649 . . . . 0.0 108.613 -172.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -71.79 -179.28 2.59 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.652 1.181 . . . . 0.0 109.563 165.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -142.99 70.84 1.33 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.18 0.992 . . . . 0.0 108.647 167.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -70.64 101.14 1.98 Allowed 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 170.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -95.3 136.29 35.84 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 175.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 29.1 mt -146.89 153.95 40.73 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.391 1.876 . . . . 0.0 106.334 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 11.9 p -76.53 154.8 34.25 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.501 -0.749 . . . . 0.0 111.2 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 11.8 mt -59.96 -25.52 65.26 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.188 -0.945 . . . . 0.0 110.531 169.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.23 -46.29 70.91 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 117.264 -1.35 . . . . 0.0 112.607 170.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.95 -60.19 2.4 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.067 1.347 . . . . 0.0 110.079 177.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.17 -42.22 85.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.345 1.458 . . . . 0.0 110.54 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -66.44 -34.07 77.12 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.471 -0.768 . . . . 0.0 110.257 -178.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.15 -66.58 0.54 Allowed 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 175.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -49.74 -42.15 45.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 126.584 1.954 . . . . 0.0 114.333 -166.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -128.1 18.51 6.56 Favored 'General case' 0 C--O 1.226 -0.146 0 CA-C-N 118.181 0.446 . . . . 0.0 111.636 -173.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -142.71 17.17 1.99 Allowed 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.631 -0.668 . . . . 0.0 111.359 177.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.59 ' NE2' HE22 ' A' ' 123' ' ' GLN . 2.6 pm0 -51.05 -74.13 0.03 OUTLIER 'General case' 0 C--N 1.351 0.663 0 CA-C-N 119.313 0.961 . . . . 0.0 111.801 165.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.64 151.04 27.8 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 -169.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 62.5 ttt-85 -75.86 -21.43 57.22 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-O 117.702 -1.142 . . . . 0.0 112.382 173.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 1.4 t -59.66 -50.25 74.6 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 119.933 1.242 . . . . 0.0 108.179 175.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.59 HE22 ' NE2' ' A' ' 119' ' ' GLN . 2.9 pt20 -61.65 -24.89 67.02 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.229 0.468 . . . . 0.0 111.917 -177.669 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -69.93 -5.19 24.36 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 118.031 -0.985 . . . . 0.0 112.677 176.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? -70.97 -75.54 0.12 Allowed 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 155.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -55.57 -47.3 76.64 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -162.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 71.2 t -55.1 -51.36 55.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 125.091 1.356 . . . . 0.0 110.194 177.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.17 -27.42 60.81 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.93 0.892 . . . . 0.0 110.926 -177.155 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.61 -51.26 70.56 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.543 2.337 . . . . 0.0 108.542 169.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -57.31 -27.96 62.64 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.577 0.751 . . . . 0.0 111.394 -178.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 60.2 t -75.36 -25.62 18.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 O-C-N 121.205 -0.935 . . . . 0.0 112.171 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -90.8 -18.11 25.46 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.457 -0.777 . . . . 0.0 111.159 173.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.31 9.91 73.4 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.063 1.316 . . . . 0.0 114.658 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.8 pp -104.65 167.64 9.6 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.968 1.307 . . . . 0.0 111.667 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 49.8 mtp85 -109.53 176.71 4.98 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 125.47 1.508 . . . . 0.0 108.671 172.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.82 3.94 1.87 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.752 0.421 . . . . 0.0 111.216 -169.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 . . . . . 0 C--O 1.246 0.915 0 C-N-CA 129.113 2.965 . . . . 0.0 109.839 -158.987 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.24 0.583 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.15 137.71 54.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.508 1.523 . . . . 0.0 107.956 175.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -69.58 -40.09 76.94 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.757 -0.59 . . . . 0.0 110.282 -166.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -45.6 -51.05 12.62 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.37 1.468 . . . . 0.0 110.231 165.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -69.59 -37.39 76.9 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.561 1.144 . . . . 0.0 112.053 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.7 mt -62.52 -36.49 75.21 Favored 'Isoleucine or valine' 0 C--N 1.342 0.278 0 CA-C-N 120.499 1.5 . . . . 0.0 110.909 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -51.85 -48.13 51.83 Favored Glycine 0 C--N 1.336 0.571 0 CA-C-N 119.65 1.113 . . . . 0.0 112.827 -174.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.4 t -62.26 -46.23 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-N 117.226 0.513 . . . . 0.0 110.084 -178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 80.6 mt -70.68 -34.09 71.61 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.327 0.651 . . . . 0.0 111.436 -176.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.26 -48.46 78.08 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.04 0.936 . . . . 0.0 109.631 171.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.75 -34.62 78.15 Favored Glycine 0 C--N 1.336 0.578 0 N-CA-C 111.644 -0.582 . . . . 0.0 111.644 175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.1 mt -63.78 -31.06 72.11 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 120.607 -1.525 . . . . 0.0 110.794 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.14 -19.14 57.27 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 117.592 -1.194 . . . . 0.0 113.252 172.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.0 mm -144.4 93.0 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 125.905 1.682 . . . . 0.0 108.085 -163.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t 56.27 71.66 1.15 Allowed Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 126.5 1.92 . . . . 0.0 111.629 -171.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -60.58 -42.88 36.42 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.447 2.098 . . . . 0.0 109.208 171.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.86 -56.23 13.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.195 1.398 . . . . 0.0 110.99 177.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 69.3 t90 -53.07 -53.21 53.66 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.543 0.61 . . . . 0.0 110.214 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.7 tt -59.1 -48.26 82.26 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 118.438 0.563 . . . . 0.0 110.678 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.0 mttm -56.0 -45.55 79.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 118.679 0.672 . . . . 0.0 110.589 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -69.3 -39.57 78.22 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -175.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -65.27 -46.84 78.85 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.391 -0.818 . . . . 0.0 111.257 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.6 mm -60.87 -35.29 63.71 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.114 0 C-N-CA 123.9 0.88 . . . . 0.0 110.416 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.48 -39.76 58.16 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.03 0.832 . . . . 0.0 111.319 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -100.98 6.23 43.45 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.013 1.725 . . . . 0.0 113.302 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 54.27 19.39 2.19 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.199 1.799 . . . . 0.0 112.147 -171.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -83.25 10.01 9.41 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 119.984 -1.698 . . . . 0.0 112.128 -178.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.4 tp -84.85 145.92 27.58 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 171.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.5 p -128.45 165.52 27.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 125.119 1.368 . . . . 0.0 108.876 167.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -134.11 159.31 41.23 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 128.874 2.87 . . . . 0.0 105.801 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.59 175.51 43.98 Favored Glycine 0 CA--C 1.517 0.184 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 177.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 42.2 mm -113.8 134.68 55.84 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.715 0 C-N-CA 126.463 1.905 . . . . 0.0 106.589 178.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.496 HG22 ' H ' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -44.51 -82.96 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.421 -1.919 1 C-N-CA 132.063 4.145 . . . . 0.0 111.718 169.067 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.496 ' H ' HG22 ' A' ' 55' ' ' VAL . 15.1 mmtt 60.33 166.24 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 124.838 1.255 . . . . 0.0 112.551 -173.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -65.08 -6.91 13.94 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.341 2.027 . . . . 0.0 115.256 167.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.2 m -91.92 -48.52 6.72 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 120.086 1.312 . . . . 0.0 113.872 -166.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.73 169.89 16.41 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.385 0.993 . . . . 0.0 108.972 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.8 m -80.13 108.52 13.79 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 174.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.6 m -131.89 163.19 51.7 Favored Pre-proline 0 C--O 1.238 0.472 0 C-N-CA 125.292 1.437 . . . . 0.0 108.972 167.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -75.6 164.06 32.91 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 121.572 1.515 . . . . 0.0 111.695 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.13 123.43 15.24 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.332 169.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 105.35 26.92 6.03 Favored Glycine 0 CA--C 1.529 0.911 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.026 172.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.1 m -144.21 81.77 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.51 1.524 . . . . 0.0 108.478 172.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -89.85 -14.42 34.39 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.15 1.908 . . . . 0.0 116.15 -172.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -165.32 14.9 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 126.863 2.065 . . . . 0.0 110.599 -176.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -77.13 110.12 11.55 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.3 m -49.99 139.05 14.5 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.36 0.664 . . . . 0.0 109.483 168.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.8 p90 -112.29 170.38 8.21 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.099 0.863 . . . . 0.0 110.703 174.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.9 mt -135.3 135.9 41.18 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.0 2.12 . . . . 0.0 106.241 169.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.418 ' HB ' HG13 ' A' ' 81' ' ' ILE . 4.1 p -144.41 162.24 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 CA-C-N 119.398 0.999 . . . . 0.0 108.727 175.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.67 122.82 28.64 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 172.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.06 -30.76 71.34 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 119.085 0.857 . . . . 0.0 110.906 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.85 -10.13 29.7 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 124.359 1.064 . . . . 0.0 112.236 -176.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.16 53.73 1.96 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 176.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -47.72 -46.4 29.63 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.918 -0.489 . . . . 0.0 112.271 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -85.75 2.63 44.74 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.937 1.295 . . . . 0.0 111.969 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.5 -69.13 1.36 Allowed Glycine 0 CA--C 1.532 1.097 0 C-N-CA 126.261 1.886 . . . . 0.0 113.893 -165.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.7 m -143.47 158.72 43.42 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.451 1.5 . . . . 0.0 109.206 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.418 HG13 ' HB ' ' A' ' 72' ' ' VAL . 7.3 tt -155.51 155.11 5.97 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-N 119.315 0.961 . . . . 0.0 109.118 177.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.4 mt -139.02 150.59 23.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 175.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -128.86 153.77 47.14 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 126.202 1.801 . . . . 0.0 107.592 171.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -152.03 158.5 43.15 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.819 1.248 . . . . 0.0 109.793 175.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.3 tttt -155.62 125.53 6.53 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 123.996 0.919 . . . . 0.0 108.898 176.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.2 158.15 32.03 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.141 0.428 . . . . 0.0 110.646 167.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -137.87 -3.65 1.81 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 177.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 113.17 81.46 1.07 Allowed Glycine 0 C--N 1.338 0.643 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 75.44 7.55 3.96 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.189 2.596 . . . . 0.0 114.527 -173.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.1 m -141.0 160.49 39.96 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.714 1.605 . . . . 0.0 108.064 174.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 87.9 t -134.23 139.77 47.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 C-N-CA 126.324 1.85 . . . . 0.0 106.371 174.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 23.8 mm -103.15 114.82 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 173.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.8 mt -94.12 130.91 42.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 173.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -125.02 97.71 5.37 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 126.994 2.118 . . . . 0.0 107.192 -176.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 25.0 p90 -124.76 169.79 11.66 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.508 -1.37 . . . . 0.0 110.094 -171.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.4 t -154.31 168.36 26.85 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.301 0.64 . . . . 0.0 109.498 176.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.0 p -91.1 -10.59 41.44 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.779 1.632 . . . . 0.0 112.244 170.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -147.17 123.25 10.78 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.385 1.074 . . . . 0.0 110.236 -170.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 -51.99 -36.03 48.46 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 125.113 1.365 . . . . 0.0 111.695 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.03 -3.48 32.75 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.947 1.699 . . . . 0.0 114.925 -173.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.4 p -119.95 171.92 8.1 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -162.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.05 152.03 41.4 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 121.287 -0.883 . . . . 0.0 109.264 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -85.53 135.37 33.85 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 172.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.72 176.12 0.41 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.266 1.427 . . . . 0.0 109.391 162.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.28 106.0 4.48 Favored 'General case' 0 C--O 1.232 0.181 0 O-C-N 121.355 -0.84 . . . . 0.0 109.561 -175.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 tppt? -121.66 108.08 13.13 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 106.363 -1.718 . . . . 0.0 106.363 171.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -81.27 140.74 34.67 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 169.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -135.3 135.96 41.23 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 106.819 -1.548 . . . . 0.0 106.819 171.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.37 153.81 33.94 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.718 0.807 . . . . 0.0 109.648 172.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.0 mt -55.68 -43.12 76.06 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.268 -1.52 . . . . 0.0 108.46 166.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.9 t -51.67 -55.09 21.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.902 -0.57 . . . . 0.0 109.959 177.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -44.53 -66.34 0.4 Allowed 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 127.568 2.347 . . . . 0.0 110.48 175.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 83.4 mt -64.14 -31.65 72.93 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.665 -175.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -70.29 -39.71 74.71 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.959 -1.088 . . . . 0.0 108.225 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -51.02 61.16 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 117.885 -1.055 . . . . 0.0 108.623 174.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -55.68 -44.81 77.65 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 118.774 0.715 . . . . 0.0 111.705 -174.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -141.85 16.36 2.13 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -157.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -148.49 42.01 0.98 Allowed 'General case' 0 C--O 1.238 0.453 0 O-C-N 120.049 -1.657 . . . . 0.0 111.496 175.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.5 -26.47 13.23 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -170.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 41.5 p -92.49 -174.97 3.85 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.167 1.387 . . . . 0.0 109.765 -178.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.29 -46.64 4.96 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 120.545 -1.347 . . . . 0.0 110.768 -176.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 70.4 m -63.0 -31.01 72.05 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 119.133 0.879 . . . . 0.0 111.297 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -62.12 -16.83 55.23 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.75 -1.219 . . . . 0.0 112.9 177.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -65.35 -25.07 67.43 Favored 'General case' 0 N--CA 1.462 0.166 0 O-C-N 121.368 -0.832 . . . . 0.0 111.014 172.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -77.33 -67.67 0.69 Allowed 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 168.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -53.65 -51.76 62.12 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 124.458 1.098 . . . . 0.0 112.57 -157.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 36.4 t -53.2 -55.48 12.38 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 C-N-CA 123.997 0.919 . . . . 0.0 109.216 178.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -67.59 -28.23 67.58 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -176.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -65.35 -38.32 89.75 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 124.553 1.141 . . . . 0.0 109.757 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 9.2 m-30 -62.47 -33.47 74.92 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.695 0.798 . . . . 0.0 111.146 169.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 11.2 t -70.24 -16.08 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 120.569 -1.332 . . . . 0.0 111.242 173.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -107.83 18.01 21.82 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.086 1.355 . . . . 0.0 110.757 173.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -122.39 18.98 8.18 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 125.658 1.599 . . . . 0.0 111.252 175.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.8 pp -125.48 151.23 46.56 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.279 1.032 . . . . 0.0 111.35 -178.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 19.1 mtt85 -72.32 178.5 3.9 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 126.98 2.112 . . . . 0.0 108.951 170.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.88 -0.89 2.05 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -175.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.256 1.417 0 C-N-CA 126.485 1.914 . . . . 0.0 108.138 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 . . . . . 0 N--CA 1.455 -0.218 0 CA-C-O 121.899 0.857 . . . . 0.0 112.732 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.743 ' HG1' ' NE2' ' A' ' 26' ' ' GLN . 16.6 p -129.69 154.59 47.0 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 104.711 -2.329 . . . . 0.0 104.711 162.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -63.75 -32.64 74.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.768 0.258 . . . . 0.0 110.406 -170.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.743 ' NE2' ' HG1' ' A' ' 24' ' ' THR . 0.1 OUTLIER -58.63 -47.71 83.47 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.056 0.943 . . . . 0.0 111.252 175.433 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -62.76 -45.8 91.02 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.366 1.066 . . . . 0.0 109.289 -175.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 28.5 mt -61.52 -44.7 99.04 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 C-N-CA 124.817 1.247 . . . . 0.0 108.342 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.57 -37.57 56.64 Favored Glycine 0 CA--C 1.523 0.562 0 C-N-CA 124.168 0.89 . . . . 0.0 111.881 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 75.5 t -64.73 -59.77 3.71 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.137 0 CA-C-N 118.47 1.135 . . . . 0.0 109.042 173.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.9 mt -58.36 -42.48 87.03 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.432 1.014 . . . . 0.0 110.787 -172.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.26 93.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.64 1.176 . . . . 0.0 111.45 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.82 -25.19 75.85 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 118.164 0.438 . . . . 0.0 112.342 175.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.1 mt -69.99 -41.09 74.84 Favored 'General case' 0 C--O 1.231 0.125 0 O-C-N 120.449 -1.618 . . . . 0.0 110.008 173.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.33 -32.13 73.47 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 119.212 -0.423 . . . . 0.0 111.312 173.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 32.1 mm -126.75 97.74 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 125.908 1.683 . . . . 0.0 107.889 -170.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.276 1.0 OUTLIER 65.83 67.67 0.72 Allowed Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.066 1.746 . . . . 0.0 112.559 173.129 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.79 -35.73 9.16 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.261 2.641 . . . . 0.0 113.285 -176.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -58.97 -58.93 6.47 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.275 1.03 . . . . 0.0 110.104 -177.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 48.8 t90 -47.7 -49.7 27.17 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.481 1.512 . . . . 0.0 111.203 175.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.7 tt -58.86 -47.56 84.48 Favored 'General case' 0 C--N 1.34 0.155 0 O-C-N 121.624 -0.672 . . . . 0.0 110.343 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -63.24 -38.5 91.4 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 117.841 -1.076 . . . . 0.0 111.606 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -61.44 -40.1 93.23 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 119.625 1.102 . . . . 0.0 109.775 176.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -75.24 -45.51 39.73 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.16 -175.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.91 -45.3 98.52 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-N 119.487 1.039 . . . . 0.0 109.627 176.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.29 -39.26 72.41 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.807 0.73 . . . . 0.0 110.306 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.93 0.79 46.43 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 44.41 45.54 7.53 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 126.463 1.905 . . . . 0.0 111.003 -168.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.514 ' HA ' HE21 ' A' ' 49' ' ' GLN . 0.0 OUTLIER -104.82 -2.31 24.93 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 177.445 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.0 tp -85.5 119.17 25.56 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 120.175 1.352 . . . . 0.0 110.638 -171.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 42.9 t -107.4 120.51 58.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 C-N-CA 125.544 1.538 . . . . 0.0 109.034 -178.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -89.94 153.3 20.72 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 128.124 2.57 . . . . 0.0 108.66 165.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -178.94 175.2 47.17 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 27.7 mm -115.12 136.3 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 124.599 1.159 . . . . 0.0 108.283 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 t -53.4 -75.82 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 129.925 3.29 . . . . 0.0 111.349 -175.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.0 mttt 59.27 167.37 0.08 OUTLIER Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 123.984 0.914 . . . . 0.0 112.191 -172.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.98 -4.47 8.93 Favored 'Trans proline' 0 CA--C 1.549 1.253 0 CA-C-N 121.104 1.43 . . . . 0.0 112.747 169.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.1 m -81.04 3.94 21.45 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 126.44 1.896 . . . . 0.0 114.989 -168.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.19 -175.42 4.1 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 120.002 1.273 . . . . 0.0 111.335 171.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -75.51 143.8 42.32 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 162.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -160.64 157.62 23.87 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 124.316 1.046 . . . . 0.0 110.296 165.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.36 -177.99 3.67 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 123.891 3.061 . . . . 0.0 111.379 174.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.71 137.2 40.47 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 123.639 0.776 . . . . 0.0 112.567 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.15 60.75 6.78 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 125.131 1.348 . . . . 0.0 109.874 173.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -144.16 30.59 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 125.536 1.535 . . . . 0.0 109.785 165.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -55.19 -15.76 2.6 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 117.7 2.481 . . . . 0.0 117.7 -160.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -154.6 26.74 0.45 Allowed 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.362 1.465 . . . . 0.0 110.488 171.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -71.96 108.85 5.42 Favored 'General case' 0 CA--C 1.519 -0.234 0 O-C-N 121.321 -0.862 . . . . 0.0 108.742 174.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.4 m -50.24 137.69 17.7 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.235 1.414 . . . . 0.0 109.846 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 23.8 p90 -118.97 160.8 21.32 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 118.71 0.686 . . . . 0.0 111.33 -177.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.0 mt -135.82 133.78 38.2 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 127.566 2.346 . . . . 0.0 106.43 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.9 p -161.72 167.87 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 105.161 -2.163 . . . . 0.0 105.161 -169.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.06 -175.93 4.83 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.999 -1.063 . . . . 0.0 108.67 169.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -93.18 -14.46 27.12 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.6 -0.688 . . . . 0.0 112.759 161.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -139.28 22.21 2.57 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.932 0.893 . . . . 0.0 112.166 -161.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -138.17 34.45 2.33 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.8 1.64 . . . . 0.0 107.926 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -60.99 -18.79 59.52 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 119.651 -1.905 . . . . 0.0 113.473 -160.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -98.73 3.47 47.63 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.786 1.634 . . . . 0.0 113.779 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -94.96 -128.84 5.53 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 125.931 1.729 . . . . 0.0 111.679 -171.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 25.4 m -70.75 156.28 39.71 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.595 -0.944 . . . . 0.0 109.069 173.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.3 tt -151.03 158.92 4.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 164.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 57.9 mt -136.07 143.12 36.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 106.055 -1.831 . . . . 0.0 106.055 174.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -122.21 154.98 36.78 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 172.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -156.69 158.82 37.65 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.24 -0.912 . . . . 0.0 108.918 169.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.4 tttt -142.19 109.35 5.54 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 160.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -82.69 149.93 27.05 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 165.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -141.64 -154.12 0.5 Allowed 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 128.352 2.661 . . . . 0.0 107.144 -171.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -68.97 89.29 0.24 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 125.073 1.32 . . . . 0.0 110.026 -176.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 62.22 11.0 4.13 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.989 2.116 . . . . 0.0 114.149 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.89 162.9 24.83 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.515 1.507 . . . . 0.0 108.934 174.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.4 p -146.82 151.86 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.145 0 C-N-CA 124.811 1.245 . . . . 0.0 108.06 168.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.4 mp -116.53 109.45 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 166.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.2 mt -83.04 127.54 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 165.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -120.15 105.29 10.84 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.417 1.887 . . . . 0.0 109.017 178.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 26.7 p90 -126.02 167.68 14.99 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.858 -1.151 . . . . 0.0 110.461 -176.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -156.79 163.59 39.06 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.574 1.55 . . . . 0.0 107.303 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 45.5 p -82.21 -17.32 46.54 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 169.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -145.43 133.17 21.08 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.94 -41.58 11.76 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 129.38 3.072 . . . . 0.0 111.312 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -81.66 7.16 13.07 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -175.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.8 p -136.71 132.61 35.11 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.018 -1.677 . . . . 0.0 111.914 -169.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.65 147.27 11.67 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.432 1.093 . . . . 0.0 112.712 -166.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -71.1 163.61 27.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.568 1.547 . . . . 0.0 111.79 -172.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.3 mptp? -84.17 177.39 8.24 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 127.454 2.302 . . . . 0.0 109.332 167.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -123.95 118.81 27.88 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.221 1.808 . . . . 0.0 107.955 171.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -127.62 126.47 42.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 103.967 -2.605 . . . . 0.0 103.967 164.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -123.86 130.29 52.36 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 120.924 1.693 . . . . 0.0 108.914 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 29.2 mt -134.48 155.88 49.59 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 -173.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.5 p -87.18 151.0 23.56 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 121.282 1.856 . . . . 0.0 109.107 170.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 16.6 mt -58.66 -40.4 83.38 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-O 121.762 0.791 . . . . 0.0 109.755 -176.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.3 -37.33 82.82 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 124.407 1.083 . . . . 0.0 110.914 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -57.77 11.09 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 125.931 1.692 . . . . 0.0 112.255 173.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . 0.559 ' HA ' ' CG ' ' A' ' 116' ' ' GLU . 14.7 mt -56.35 -33.01 65.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.702 1.137 . . . . 0.0 110.136 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -72.59 12.1 0.53 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.127 1.371 . . . . 0.0 113.713 175.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.26 -35.02 1.04 Allowed 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.945 1.698 . . . . 0.0 110.86 -176.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . 0.559 ' CG ' ' HA ' ' A' ' 113' ' ' LEU . 2.4 pt-20 -61.91 -86.41 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 154.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.456 ' CD2' ' HB2' ' A' ' 116' ' ' GLU . 98.7 m-85 -90.82 18.57 6.37 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.724 0.773 . . . . 0.0 110.233 -162.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -147.23 100.18 3.24 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 174.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -132.33 -33.56 1.28 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.8 t -130.95 143.31 50.63 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 120.827 1.649 . . . . 0.0 110.441 -168.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -62.14 -36.59 82.26 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 119.756 -1.84 . . . . 0.0 112.334 -171.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 26.9 t -62.52 -20.1 64.28 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 117.23 -1.367 . . . . 0.0 112.934 176.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -66.32 -23.37 66.35 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 121.046 1.748 . . . . 0.0 111.508 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.7 mttt -60.61 -6.35 1.63 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 126.335 1.854 . . . . 0.0 113.342 -175.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -104.56 -8.82 18.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 122.903 1.335 . . . . 0.0 114.122 -176.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.95 -62.66 1.56 Allowed 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 127.272 2.229 . . . . 0.0 108.916 176.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.8 t -57.69 -42.77 82.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 124.409 1.084 . . . . 0.0 111.467 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -76.27 -13.79 60.15 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 171.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -79.47 -41.72 26.87 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 125.051 1.34 . . . . 0.0 112.849 -179.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -59.02 -29.23 67.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.912 0.485 . . . . 0.0 110.29 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.3 t -67.03 -26.82 37.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 123.926 0.89 . . . . 0.0 111.437 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -96.96 -16.46 20.62 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.82 0.736 . . . . 0.0 111.849 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.43 -7.38 76.13 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.705 0.684 . . . . 0.0 112.878 -179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -84.81 176.19 8.67 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.902 1.281 . . . . 0.0 109.757 167.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -139.06 165.85 26.05 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 127.101 2.16 . . . . 0.0 108.368 -175.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.11 21.52 6.26 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.838 0.855 . . . . 0.0 110.459 178.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 . . . . . 0 C--O 1.251 1.153 0 C-N-CA 129.839 3.256 . . . . 0.0 110.249 -160.288 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 . . . . . 0 CA--C 1.542 0.673 0 CA-C-O 121.287 0.565 . . . . 0.0 109.498 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.6 146.6 48.11 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 128.075 2.55 . . . . 0.0 106.143 171.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -55.86 -39.89 72.13 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.867 0.467 . . . . 0.0 110.45 -171.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -45.48 94.56 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.175 0.898 . . . . 0.0 110.511 -176.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.5 mm-40 -61.01 -34.93 75.59 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 124.835 1.254 . . . . 0.0 110.817 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 96.6 mt -74.05 -41.14 52.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 C-N-CA 124.517 1.127 . . . . 0.0 109.748 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.58 -42.49 90.49 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 124.967 1.27 . . . . 0.0 111.797 -175.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.3 t -60.82 -45.45 97.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-N 117.107 0.454 . . . . 0.0 110.742 176.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 46.1 mt -63.61 -45.37 90.61 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.933 0.788 . . . . 0.0 109.593 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.54 -47.45 73.16 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.386 1.075 . . . . 0.0 110.251 176.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.41 -22.67 78.81 Favored Glycine 0 CA--C 1.523 0.579 0 O-C-N 121.696 -0.627 . . . . 0.0 112.504 178.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 tp -69.61 -17.79 63.56 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.052 1.926 . . . . 0.0 112.207 174.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -91.26 -20.88 21.43 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 117.012 -1.47 . . . . 0.0 113.083 170.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.5 mp -134.28 105.58 6.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 -176.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.287 2.3 p 57.31 62.06 5.9 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.665 1.986 . . . . 0.0 112.141 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.41 -42.14 7.82 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.914 3.076 . . . . 0.0 111.016 176.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.57 -51.38 63.05 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -172.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -45.62 -48.13 14.7 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.873 0.869 . . . . 0.0 111.194 168.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.7 -52.59 63.69 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 -175.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -64.38 -32.99 74.82 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.132 0.973 . . . . 0.0 112.321 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -62.42 -52.06 65.05 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 119.887 1.221 . . . . 0.0 108.29 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -66.55 -37.44 84.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 117.972 -1.013 . . . . 0.0 111.875 -176.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 31.5 mm -59.19 -51.04 77.26 Favored 'Isoleucine or valine' 0 C--N 1.342 0.26 0 CA-C-N 119.777 1.171 . . . . 0.0 109.441 172.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.38 -38.14 79.74 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.992 0.815 . . . . 0.0 111.068 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.07 -8.3 55.12 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.299 1.04 . . . . 0.0 113.134 176.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 48.05 37.47 7.89 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.62 1.568 . . . . 0.0 112.016 -166.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.5 -6.66 21.56 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.456 1.502 . . . . 0.0 112.288 -177.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.26 128.85 35.88 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -173.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.6 t -114.31 156.49 15.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 174.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -123.31 145.25 48.87 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 127.423 2.289 . . . . 0.0 106.777 176.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -158.01 175.11 35.3 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 121.76 0.644 . . . . 0.0 113.451 -178.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mm -123.02 135.92 61.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.599 0 CA-C-O 124.808 2.242 . . . . 0.0 107.423 177.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.449 HG21 ' H ' ' A' ' 68' ' ' TYR . 0.8 OUTLIER -68.03 -59.18 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.809 0 C-N-CA 131.282 3.833 . . . . 0.0 109.817 -177.346 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 56.52 165.23 0.07 OUTLIER Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 127.681 2.392 . . . . 0.0 113.34 -170.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.25 80.54 1.01 Allowed 'Trans proline' 0 N--CA 1.448 -1.182 0 N-CA-C 107.528 -1.758 . . . . 0.0 107.528 155.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.5 t -159.1 -72.72 0.08 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.309 -1.738 . . . . 0.0 106.309 162.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.89 160.84 7.18 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 123.525 0.73 . . . . 0.0 112.611 -164.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 m -66.42 112.03 3.85 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 172.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.5 m -140.0 160.58 59.89 Favored Pre-proline 0 C--O 1.238 0.488 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.28 168.02 18.84 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.37 2.047 . . . . 0.0 110.794 171.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.11 132.86 49.48 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 171.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 99.7 37.32 3.99 Favored Glycine 0 CA--C 1.492 -1.395 0 CA-C-O 118.399 -1.223 . . . . 0.0 114.198 170.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.448 ' CG2' ' HB2' ' A' ' 68' ' ' TYR 0.296 1.6 p -174.1 56.17 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 CA-C-O 123.018 1.39 . . . . 0.0 107.701 -168.175 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -86.76 -4.52 59.19 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.732 1.613 . . . . 0.0 112.011 177.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -164.51 20.48 0.06 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.031 2.132 . . . . 0.0 110.719 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.449 ' H ' HG21 ' A' ' 55' ' ' VAL . 4.5 m-85 -83.69 100.18 10.71 Favored 'General case' 0 CA--C 1.52 -0.185 0 C-N-CA 126.128 1.771 . . . . 0.0 109.241 174.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -44.2 139.96 2.36 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 127.096 2.158 . . . . 0.0 111.86 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -127.12 166.93 16.72 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.485 1.114 . . . . 0.0 112.731 -175.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 19.1 mt -139.16 124.9 19.59 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 127.387 2.275 . . . . 0.0 106.347 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -150.59 143.47 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 126.138 1.775 . . . . 0.0 106.463 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.1 156.15 34.11 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 169.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.95 -24.32 62.44 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -174.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -111.46 3.73 18.33 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.434 1.894 . . . . 0.0 110.952 -174.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -101.27 19.82 16.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.203 1.801 . . . . 0.0 111.23 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -44.97 -43.34 8.99 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 126.532 1.933 . . . . 0.0 113.693 -169.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -124.99 13.78 8.46 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.662 1.185 . . . . 0.0 111.479 170.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.67 -68.65 1.52 Allowed Glycine 0 CA--C 1.522 0.518 0 C-N-CA 126.215 1.864 . . . . 0.0 110.209 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.4 m -148.91 156.98 43.08 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.861 0.864 . . . . 0.0 108.805 179.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.5 tt -155.88 159.79 2.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 172.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.7 mt -134.93 157.04 40.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 166.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -133.13 155.97 48.29 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.122 2.569 . . . . 0.0 107.624 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -164.79 160.45 19.62 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.472 -1.393 . . . . 0.0 109.29 175.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.11 127.45 12.19 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 169.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.56 117.67 19.96 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 164.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -100.28 22.28 11.77 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.58 1.552 . . . . 0.0 109.703 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 86.58 121.09 1.3 Allowed Glycine 0 C--N 1.34 0.78 0 C-N-CA 125.324 1.44 . . . . 0.0 110.417 -177.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 50.82 1.01 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.656 2.382 . . . . 0.0 116.385 -171.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -151.5 145.27 25.06 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 126.028 1.731 . . . . 0.0 107.112 -162.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 68.0 t -138.4 108.63 4.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 125.119 1.368 . . . . 0.0 108.075 -175.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.5 mp -77.88 104.62 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 162.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 34.2 mt -76.98 135.15 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 106.212 -1.773 . . . . 0.0 106.212 165.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -126.74 103.07 7.34 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.628 1.571 . . . . 0.0 109.825 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -119.72 165.56 14.36 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.067 -1.646 . . . . 0.0 111.322 -174.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.6 t -156.9 169.97 23.56 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.588 1.555 . . . . 0.0 108.019 171.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 m -109.86 -9.05 14.81 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.19 1.396 . . . . 0.0 111.114 172.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -136.0 112.82 10.22 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.5 1.52 . . . . 0.0 108.586 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -48.44 -32.89 8.38 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 126.188 1.795 . . . . 0.0 112.583 175.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . 0.296 0.0 OUTLIER -79.29 3.77 17.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.132 1.901 . . . . 0.0 116.132 178.051 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.2 p -120.3 165.75 14.44 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 119.078 0.854 . . . . 0.0 111.168 -178.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -66.26 158.01 30.07 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.341 0.591 . . . . 0.0 110.247 -174.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 61.2 mt -91.38 142.7 27.4 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.475 0.71 . . . . 0.0 109.457 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.08 173.08 0.87 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.348 0.659 . . . . 0.0 109.533 164.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.62 112.66 9.09 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.549 1.14 . . . . 0.0 108.199 170.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.2 tptt -123.03 97.69 5.55 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 105.314 -2.106 . . . . 0.0 105.314 178.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.94 126.57 35.45 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 178.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -123.3 157.94 32.09 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.895 1.278 . . . . 0.0 108.179 174.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.3 158.87 33.24 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.346 -0.846 . . . . 0.0 110.145 162.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 17.2 mt -47.13 -54.49 10.41 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.168 0.987 . . . . 0.0 109.665 162.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.27 -30.84 70.71 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 117.138 -1.41 . . . . 0.0 112.116 -174.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -62.79 -57.83 9.55 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 120.073 1.306 . . . . 0.0 109.867 173.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 92.8 mt -55.64 -32.14 62.92 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.463 0.574 . . . . 0.0 111.376 -178.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.8 tttm -70.64 -47.03 62.11 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 118.677 -0.678 . . . . 0.0 111.635 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -50.83 71.83 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 119.155 0.889 . . . . 0.0 108.773 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -57.36 -62.38 1.81 Allowed 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 124.882 1.273 . . . . 0.0 109.025 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . 0.431 ' C ' HE21 ' A' ' 123' ' ' GLN . 19.2 m-85 -127.99 13.38 6.77 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -157.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -143.77 58.03 1.36 Allowed 'General case' 0 C--O 1.24 0.586 0 O-C-N 119.792 -1.818 . . . . 0.0 109.901 173.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.624 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -108.47 -34.69 6.69 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.825 -168.39 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.2 t -107.55 148.05 29.75 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 125.297 1.439 . . . . 0.0 110.294 -173.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -60.82 -28.97 69.2 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.684 -1.26 . . . . 0.0 110.756 175.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.97 -39.22 74.18 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 119.589 1.086 . . . . 0.0 111.243 176.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.624 HE22 ' NE2' ' A' ' 119' ' ' GLN . 0.0 OUTLIER -61.95 -18.52 60.64 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 179.611 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -78.32 -2.46 38.2 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.659 178.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.87 -79.71 0.2 Allowed 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 153.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -52.11 -61.88 1.99 Allowed 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -160.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 76.0 t -55.8 -36.94 45.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 118.534 0.606 . . . . 0.0 110.559 -176.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -77.34 -30.22 53.85 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.999 1.32 . . . . 0.0 111.896 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.41 -49.76 74.2 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 126.009 1.724 . . . . 0.0 109.394 164.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -59.25 -38.77 80.88 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.769 0.713 . . . . 0.0 110.543 -176.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 90.1 t -64.3 -33.26 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 118.983 0.811 . . . . 0.0 111.08 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -86.38 -23.35 26.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 118.86 0.755 . . . . 0.0 112.53 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.88 -32.19 13.4 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 125.003 1.287 . . . . 0.0 111.825 -176.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.3 pp -56.5 125.5 22.35 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 166.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -79.73 167.37 20.72 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 9.9 m -134.43 6.64 3.55 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 120.353 -1.467 . . . . 0.0 111.398 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.921 0 C-N-CA 127.719 2.408 . . . . 0.0 104.774 163.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.456 ' CZ ' ' HE3' ' A' ' 114' ' ' LYS . 4.5 m-85 . . . . . 0 CA--C 1.548 0.896 0 CA-C-O 121.109 0.481 . . . . 0.0 110.983 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.3 p -138.53 150.26 46.19 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.787 2.035 . . . . 0.0 107.326 171.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -59.4 -41.72 90.1 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.423 0.556 . . . . 0.0 110.106 -174.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -44.44 -56.04 4.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.385 1.874 . . . . 0.0 111.433 169.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -69.43 -30.86 68.89 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.904 1.282 . . . . 0.0 112.605 -174.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 48.2 mt -80.2 -34.96 15.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 C-N-CA 123.22 0.608 . . . . 0.0 109.821 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.403 ' CA ' ' CZ ' ' A' ' 84' ' ' PHE . . . -55.73 -44.97 86.69 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 124.048 0.832 . . . . 0.0 112.055 -173.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.6 t -56.02 -50.49 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 118.306 1.053 . . . . 0.0 109.321 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 53.4 mt -58.26 -39.31 78.87 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.334 0.97 . . . . 0.0 110.832 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.13 -47.35 80.27 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 118.879 -0.581 . . . . 0.0 111.816 176.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.71 -29.27 72.73 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.976 0.807 . . . . 0.0 111.378 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.8 mt -62.08 -28.31 69.52 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 120.356 -1.673 . . . . 0.0 110.62 172.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.26 -12.99 59.95 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 117.111 -1.423 . . . . 0.0 113.094 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.0 mm -143.64 98.95 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 125.799 1.64 . . . . 0.0 107.309 -173.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t 56.71 68.65 2.06 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 124.836 1.254 . . . . 0.0 112.083 -175.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.32 -37.87 69.44 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.328 2.018 . . . . 0.0 110.711 176.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -47.01 77.74 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 118.185 -0.912 . . . . 0.0 112.078 -173.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 59.4 t90 -52.93 -52.94 56.13 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tt -58.15 -52.0 67.38 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 121.454 -0.779 . . . . 0.0 110.929 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -57.83 -35.17 70.51 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 118.574 -0.727 . . . . 0.0 111.123 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -69.66 -50.7 41.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 178.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -59.19 -38.41 79.76 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.354 -0.831 . . . . 0.0 112.305 -177.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 31.4 mm -60.53 -53.19 52.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 119.319 0.963 . . . . 0.0 109.36 173.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.65 -41.2 81.0 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 117.836 0.289 . . . . 0.0 110.749 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.53 -17.66 63.6 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.505 1.522 . . . . 0.0 113.141 176.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.1 t30 59.02 30.05 19.77 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.641 1.577 . . . . 0.0 110.838 -169.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -94.22 -16.65 23.46 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.879 1.272 . . . . 0.0 112.703 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.57 135.7 35.57 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.439 1.496 . . . . 0.0 109.59 -169.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 45.8 t -122.15 145.69 28.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 124.759 1.224 . . . . 0.0 108.004 170.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -106.31 136.22 46.42 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 128.049 2.54 . . . . 0.0 106.683 173.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -153.36 178.65 30.27 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-O 122.9 1.278 . . . . 0.0 113.697 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 26.8 mm -130.49 137.82 55.27 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.932 0 C-N-CA 127.981 2.512 . . . . 0.0 108.14 -171.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.484 HG22 ' H ' ' A' ' 68' ' ' TYR 0.255 2.8 m -70.59 -75.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.409 -2.503 0 CA-C-N 108.823 -3.808 . . . . 0.0 108.675 179.398 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.454 ' H ' HG21 ' A' ' 55' ' ' VAL . 13.7 mmtp 55.39 167.39 0.05 OUTLIER Pre-proline 0 C--N 1.349 0.543 0 C-N-CA 125.301 1.44 . . . . 0.0 111.573 -173.291 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -66.84 73.18 0.44 Allowed 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 121.719 1.613 . . . . 0.0 110.375 164.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.3 t -153.16 -63.67 0.15 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.826 1.25 . . . . 0.0 112.65 175.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.68 175.73 9.08 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 120.566 1.53 . . . . 0.0 110.935 -172.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 t -93.69 121.15 34.83 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 -179.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.8 m -150.42 160.8 32.28 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 123.957 0.903 . . . . 0.0 109.011 -176.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -71.5 158.92 52.79 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.937 1.758 . . . . 0.0 111.092 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.19 129.55 40.62 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 173.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.64 22.99 9.72 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 117.461 -1.744 . . . . 0.0 114.824 174.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.2 m -141.2 70.01 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.8 1.8 . . . . 0.0 110.1 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -85.3 -11.49 54.58 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.923 1.689 . . . . 0.0 114.61 -172.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -170.44 25.68 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 126.266 1.826 . . . . 0.0 109.506 -166.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.484 ' H ' HG22 ' A' ' 55' ' ' VAL . 3.5 m-85 -94.98 105.75 17.69 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.687 1.595 . . . . 0.0 107.426 176.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.08 150.11 4.66 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 118.99 0.813 . . . . 0.0 110.69 172.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -130.73 158.46 40.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.174 0.59 . . . . 0.0 111.03 -176.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -120.63 128.48 53.05 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 127.096 2.158 . . . . 0.0 106.98 174.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -153.22 159.62 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 173.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.78 161.45 16.02 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.371 0.605 . . . . 0.0 110.407 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.8 -5.59 4.5 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.106 0.962 . . . . 0.0 113.52 172.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -140.3 22.63 2.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.659 0.784 . . . . 0.0 110.972 -175.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -127.0 29.18 5.66 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.407 1.883 . . . . 0.0 109.407 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -63.61 -5.33 3.81 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 119.252 -2.155 . . . . 0.0 114.33 -177.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -143.19 22.49 1.88 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.093 1.357 . . . . 0.0 111.511 160.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.12 -71.83 1.31 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 125.634 1.587 . . . . 0.0 111.198 -176.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 21.4 m -145.29 160.78 40.99 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.206 1.802 . . . . 0.0 107.572 177.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tt -152.4 155.04 7.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 168.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 16.2 mt -130.76 140.52 48.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 166.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -114.83 146.82 40.64 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.326 1.85 . . . . 0.0 109.2 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . 0.403 ' CZ ' ' CA ' ' A' ' 29' ' ' GLY . 45.1 p90 -151.59 156.74 41.07 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.126 -0.984 . . . . 0.0 110.92 172.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.408 ' HB2' ' CD1' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -148.57 90.29 1.77 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.859 2.064 . . . . 0.0 110.248 178.836 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.36 104.42 3.74 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 119.287 -0.965 . . . . 0.0 109.006 172.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.14 128.83 55.34 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 125.666 1.586 . . . . 0.0 108.265 174.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 57.19 -89.23 0.01 OUTLIER Glycine 0 CA--C 1.528 0.875 0 C-N-CA 125.035 1.302 . . . . 0.0 111.735 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 -137.85 17.21 2.86 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.421 2.688 . . . . 0.0 112.024 -174.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 88.6 m -137.29 142.3 41.93 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.981 1.712 . . . . 0.0 110.154 -172.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.8 t -128.36 100.72 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 126.566 1.947 . . . . 0.0 107.04 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.3 mp -72.44 77.62 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 130.091 3.357 . . . . 0.0 109.198 165.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mt -65.14 129.85 29.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 173.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -128.47 121.3 28.61 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.533 1.133 . . . . 0.0 108.073 -176.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -145.21 169.54 18.01 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 121.122 -0.986 . . . . 0.0 110.72 -168.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.5 t -157.01 174.45 15.5 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.623 0.725 . . . . 0.0 111.29 -171.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.2 p -106.58 -8.99 16.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.615 1.166 . . . . 0.0 112.056 165.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -144.42 147.57 33.53 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.68 0.792 . . . . 0.0 111.827 -175.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.9 ttt-85 -81.57 10.94 5.13 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.582 1.153 . . . . 0.0 112.088 173.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -116.86 3.74 12.91 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.418 1.487 . . . . 0.0 114.039 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 34.4 p -130.27 176.1 8.39 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.75 0.82 . . . . 0.0 112.702 -166.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.73 148.56 44.55 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.027 1.331 . . . . 0.0 109.061 172.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 84.9 mt -86.42 142.12 28.65 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 126.434 1.894 . . . . 0.0 108.872 175.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -64.37 168.81 5.28 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.276 1.03 . . . . 0.0 109.841 167.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -129.43 103.72 7.07 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.274 1.43 . . . . 0.0 109.55 -179.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.1 tptt -122.29 92.16 3.66 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -82.01 120.25 25.02 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 171.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.12 145.49 45.91 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 126.737 2.015 . . . . 0.0 106.674 168.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 2.4 p -67.37 157.59 33.69 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 121.536 -0.727 . . . . 0.0 111.207 173.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.87 -46.04 64.33 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 121.823 -0.548 . . . . 0.0 110.493 166.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.26 -41.01 98.99 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 117.194 -1.384 . . . . 0.0 111.081 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -62.39 1.64 Allowed 'General case' 0 C--N 1.345 0.41 0 CA-C-N 119.402 1.001 . . . . 0.0 109.382 174.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 56.7 mt -60.97 -38.27 85.35 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -174.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.456 ' HE3' ' CZ ' ' A' ' 23' ' ' PHE . 1.9 ttmp? -62.99 -43.1 99.72 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 118.849 -0.596 . . . . 0.0 109.77 176.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -56.38 13.94 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.491 1.041 . . . . 0.0 108.354 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -51.69 -42.12 61.94 Favored 'General case' 0 C--O 1.23 0.075 0 C-N-CA 124.929 1.292 . . . . 0.0 111.899 -174.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -132.01 20.39 4.52 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.8 0.44 . . . . 0.0 112.135 -165.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -161.99 61.43 0.24 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 122.125 0.964 . . . . 0.0 111.082 176.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.63 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -103.27 -47.85 4.19 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.016 0.926 . . . . 0.0 111.697 179.611 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' THR . . . . . 0.463 ' H ' ' NE2' ' A' ' 123' ' ' GLN . 80.8 p -88.5 161.49 16.96 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 121.246 -0.909 . . . . 0.0 110.137 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -83.06 -32.2 26.94 Favored 'General case' 0 C--N 1.334 -0.104 0 O-C-N 121.807 -0.558 . . . . 0.0 110.599 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.88 -37.09 80.98 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.981 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.63 HE22 ' NE2' ' A' ' 119' ' ' GLN . 2.8 pt20 -65.92 -29.16 69.53 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.972 1.26 . . . . 0.0 111.793 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -56.38 -34.34 66.58 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 118.741 -0.647 . . . . 0.0 112.328 -172.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.56 -71.14 0.08 Allowed 'General case' 0 C--O 1.215 -0.739 0 C-N-CA 125.566 1.546 . . . . 0.0 108.155 174.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -47.9 -57.81 5.21 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 124.165 0.986 . . . . 0.0 112.585 178.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 92.3 t -55.95 -41.92 69.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.636 -174.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -77.76 -28.68 50.71 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.787 0.721 . . . . 0.0 112.091 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -58.91 -44.65 91.32 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 169.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -58.75 -28.48 65.92 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.225 0.61 . . . . 0.0 111.05 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.71 -14.22 18.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 123.609 0.764 . . . . 0.0 111.628 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -123.0 -12.36 7.98 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 120.174 1.352 . . . . 0.0 112.858 178.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -79.89 -21.08 66.59 Favored Glycine 0 CA--C 1.525 0.665 0 O-C-N 121.466 -0.771 . . . . 0.0 111.269 168.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.4 pp -68.52 141.04 55.65 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.369 1.085 . . . . 0.0 108.118 162.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -88.69 170.26 10.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 169.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 8.5 m -130.92 9.26 4.89 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.821 -1.175 . . . . 0.0 110.215 172.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 C--O 1.236 0.375 0 C-N-CA 128.24 2.616 . . . . 0.0 104.48 172.791 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 . . . . . 0 C--O 1.234 0.254 0 CA-C-O 122.375 1.083 . . . . 0.0 109.255 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -137.17 155.97 48.91 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 126.929 2.092 . . . . 0.0 107.243 -170.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -49.68 -49.22 48.39 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.444 1.098 . . . . 0.0 110.722 175.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -44.82 -56.9 4.1 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.319 1.448 . . . . 0.0 112.332 172.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -70.92 -39.24 72.82 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.276 1.03 . . . . 0.0 110.602 -171.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 79.2 mt -64.86 -31.72 55.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.247 1.019 . . . . 0.0 109.237 175.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -49.44 -55.22 13.68 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 125.759 1.647 . . . . 0.0 111.843 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.0 t -68.31 -39.39 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 119.026 -0.512 . . . . 0.0 109.64 -173.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.9 mp -62.0 -52.74 62.78 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.908 0.776 . . . . 0.0 111.034 177.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.19 -31.43 72.57 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.574 0.625 . . . . 0.0 111.049 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.5 -27.24 70.56 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 118.637 0.653 . . . . 0.0 112.988 172.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.25 -27.45 60.77 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.977 1.889 . . . . 0.0 112.098 177.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.8 -25.92 64.93 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.891 170.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.1 mm -130.86 87.44 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 124.601 1.16 . . . . 0.0 108.68 -166.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.96 60.29 0.62 Allowed Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.009 1.324 . . . . 0.0 111.552 172.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -57.94 -37.52 95.79 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 123.236 2.624 . . . . 0.0 111.601 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -60.07 -41.66 92.89 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.376 0.67 . . . . 0.0 111.434 -178.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 37.1 t90 -61.16 -57.64 11.64 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 tt -50.25 -48.26 54.81 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.529 0.732 . . . . 0.0 110.337 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -63.95 -45.4 89.35 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.836 0.854 . . . . 0.0 111.376 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -59.89 -40.41 88.63 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.93 0.786 . . . . 0.0 111.208 173.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -63.68 -54.34 37.05 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -178.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 30.0 mm -55.49 -41.72 64.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.407 1.083 . . . . 0.0 109.691 178.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.84 7.21 1.64 Allowed 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.35 21.71 2.96 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.364 -0.835 . . . . 0.0 110.731 159.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.2 t30 50.95 25.0 2.02 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.373 2.269 . . . . 0.0 112.96 -175.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -81.24 -15.23 56.22 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 119.909 -1.744 . . . . 0.0 112.721 -174.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 tp -69.45 133.64 47.98 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 119.459 1.027 . . . . 0.0 109.044 -175.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.8 t -112.91 154.79 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 106.257 -1.757 . . . . 0.0 106.257 169.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -123.0 145.97 48.04 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 128.394 2.678 . . . . 0.0 107.209 173.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -162.86 171.13 38.58 Favored Glycine 0 C--N 1.332 0.348 0 O-C-N 121.166 -0.959 . . . . 0.0 113.687 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 31.4 mm -114.98 133.38 61.33 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.595 0 C-N-CA 126.804 2.042 . . . . 0.0 106.417 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -44.5 -54.21 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.589 1 C-N-CA 133.237 4.615 . . . . 0.0 112.266 169.271 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 19.8 mttt 62.89 159.65 0.12 Allowed Pre-proline 0 CA--C 1.536 0.421 0 C-N-CA 126.666 1.987 . . . . 0.0 112.971 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -70.75 -12.28 30.79 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.324 2.682 . . . . 0.0 113.278 -178.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 47.8 m -149.55 90.69 1.74 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.366 1.466 . . . . 0.0 107.795 170.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -138.92 -165.16 1.78 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 156.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.7 t -92.71 36.76 1.01 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.336 1.454 . . . . 0.0 112.585 -170.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.5 m -105.73 153.24 40.1 Favored Pre-proline 0 C--N 1.324 -0.539 0 C-N-CA 123.43 0.692 . . . . 0.0 109.252 -167.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.99 178.04 4.47 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.998 2.465 . . . . 0.0 111.311 -174.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.92 160.04 24.8 Favored 'General case' 0 C--O 1.238 0.482 0 O-C-N 121.185 -0.947 . . . . 0.0 109.35 170.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.9 33.74 65.81 Favored Glycine 0 CA--C 1.529 0.967 0 CA-C-O 119.615 -0.547 . . . . 0.0 112.117 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.2 m -146.34 25.38 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 125.923 1.689 . . . . 0.0 110.398 176.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.47 -5.14 0.3 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 127.778 2.431 . . . . 0.0 116.674 -164.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -157.57 15.98 0.25 Allowed 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 127.187 2.195 . . . . 0.0 109.883 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.484 ' CE2' ' HE3' ' A' ' 94' ' ' LYS . 5.6 m-85 -86.98 100.83 12.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.23 148.6 8.24 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.685 0.675 . . . . 0.0 110.076 174.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 46.6 p90 -123.38 166.78 14.76 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.422 1.089 . . . . 0.0 111.244 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 31.2 mt -136.27 130.46 33.03 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 127.564 2.346 . . . . 0.0 105.282 176.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.1 p -148.96 151.77 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 176.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -86.49 143.89 27.52 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.56 1.073 . . . . 0.0 109.003 176.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.19 -10.26 4.3 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 128.246 2.618 . . . . 0.0 114.604 -171.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.83 7.05 4.37 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.804 1.241 . . . . 0.0 111.609 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -134.58 31.82 3.37 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.188 1.795 . . . . 0.0 107.215 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -67.87 -18.69 64.89 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.449 1.5 . . . . 0.0 113.116 -166.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.75 20.66 12.24 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.59 1.956 . . . . 0.0 109.471 174.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.2 -98.36 2.56 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 126.535 2.017 . . . . 0.0 109.478 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.4 m -74.58 162.28 28.92 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.603 1.161 . . . . 0.0 108.57 169.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.9 tt -161.42 154.83 3.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 O-C-N 121.005 -1.059 . . . . 0.0 108.741 153.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.6 mt -138.34 147.77 25.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 175.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -133.39 156.66 47.26 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 127.894 2.477 . . . . 0.0 108.567 -174.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -162.7 159.61 24.54 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.408 -1.432 . . . . 0.0 111.174 174.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.52 115.88 6.2 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.94 1.296 . . . . 0.0 109.875 176.3 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.26 96.84 1.15 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.712 0.805 . . . . 0.0 109.482 167.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -64.18 -17.23 63.32 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.867 -0.587 . . . . 0.0 111.052 163.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 100.78 122.61 4.99 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 108.409 -1.876 . . . . 0.0 108.409 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 60.35 -7.14 0.08 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.067 1.747 . . . . 0.0 113.614 -161.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.07 146.29 36.96 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 128.148 2.579 . . . . 0.0 107.861 178.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 41.2 t -132.82 114.32 21.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 172.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 2.8 mp -79.71 105.25 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 N-CA-C 104.544 -2.391 . . . . 0.0 104.544 171.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 2.9 mt -77.32 142.09 14.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 106.359 -1.719 . . . . 0.0 106.359 169.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.484 ' HE3' ' CE2' ' A' ' 68' ' ' TYR . 88.6 mttt -132.13 123.52 27.28 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.904 1.281 . . . . 0.0 108.615 171.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -142.22 166.76 23.81 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.901 -1.124 . . . . 0.0 111.126 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.4 t -154.19 175.83 13.0 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 124.523 1.129 . . . . 0.0 109.259 -172.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 93.2 p -119.78 3.84 11.06 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.273 1.029 . . . . 0.0 111.811 166.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -137.85 141.64 40.75 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 157.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -50.7 -42.47 57.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.56 1.144 . . . . 0.0 109.972 174.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -95.04 24.82 4.57 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 129.066 2.946 . . . . 0.0 113.454 -173.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 67.7 p -126.74 159.12 34.66 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.793 1.633 . . . . 0.0 109.359 170.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -64.87 130.26 42.79 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 121.372 -0.83 . . . . 0.0 110.019 -174.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.45 152.38 34.52 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.243 1.817 . . . . 0.0 110.815 177.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -73.75 174.88 7.79 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.919 1.688 . . . . 0.0 109.804 168.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -119.24 132.33 55.91 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.049 1.339 . . . . 0.0 109.145 168.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.01 130.41 17.71 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 167.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -140.53 92.16 2.49 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 119.829 1.195 . . . . 0.0 109.586 -167.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.05 166.45 11.23 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.045 0.938 . . . . 0.0 109.203 -174.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 42.0 p -84.93 161.99 19.61 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 123.088 0.555 . . . . 0.0 112.043 177.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.8 mt -57.78 -40.1 79.02 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 174.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.45 -37.0 82.3 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 116.238 -1.839 . . . . 0.0 111.554 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.28 -63.83 1.0 Allowed 'General case' 0 C--N 1.347 0.496 0 CA-C-N 121.64 2.018 . . . . 0.0 110.746 169.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 29.2 mt -55.84 -34.36 65.34 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.214 0.531 . . . . 0.0 110.893 -175.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -71.17 -40.4 71.31 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.148 0.579 . . . . 0.0 111.174 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.77 -14.64 61.58 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 124.646 1.178 . . . . 0.0 112.236 176.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -101.08 -41.76 6.64 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 123.456 0.703 . . . . 0.0 110.227 -173.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -130.98 -0.5 4.17 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -168.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -136.11 54.77 1.88 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 122.912 1.339 . . . . 0.0 110.617 -176.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -88.25 -59.04 2.35 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 127.561 2.344 . . . . 0.0 114.728 174.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.9 p -77.57 -166.96 0.84 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.882 1.673 . . . . 0.0 111.886 -164.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.24 -51.16 3.01 Favored 'General case' 0 CA--C 1.522 -0.103 0 C-N-CA 124.701 1.201 . . . . 0.0 108.604 -178.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.6 t -57.65 -30.44 65.41 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.262 1.825 . . . . 0.0 112.041 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -53.68 -32.4 51.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.668 1.576 . . . . 0.0 111.559 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -68.37 0.42 3.92 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 125.108 1.363 . . . . 0.0 112.361 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -108.78 0.19 20.28 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.566 1.546 . . . . 0.0 111.325 175.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -121.4 -64.7 1.2 Allowed 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 125.538 1.535 . . . . 0.0 107.478 173.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 21.9 t -52.23 -47.31 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.468 1.507 . . . . 0.0 111.056 -178.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -67.94 -32.31 72.66 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.35 0.871 . . . . 0.0 113.35 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -75.97 -35.02 59.81 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 126.672 1.989 . . . . 0.0 110.594 -172.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -60.89 -33.96 73.92 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 127.678 2.391 . . . . 0.0 111.172 171.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 52.7 t -66.37 -22.24 29.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 O-C-N 121.317 -0.865 . . . . 0.0 110.689 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -98.04 -12.26 22.08 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.611 1.164 . . . . 0.0 112.413 171.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.6 12.1 66.35 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 125.402 1.477 . . . . 0.0 112.414 178.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.9 pp -119.28 177.27 4.96 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.886 1.674 . . . . 0.0 109.405 174.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -130.65 176.03 8.52 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 127.029 2.132 . . . . 0.0 108.754 -168.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -133.69 -0.67 3.15 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.368 0.985 . . . . 0.0 113.087 -175.491 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.252 1.197 0 C-N-CA 127.763 2.425 . . . . 0.0 107.104 -155.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 . . . . . 0 N--CA 1.469 0.489 0 CA-C-O 121.199 0.523 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.2 p -110.96 149.64 30.38 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 120.953 -1.092 . . . . 0.0 109.458 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -54.71 -31.02 57.55 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.381 1.472 . . . . 0.0 111.335 -176.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -59.87 -60.1 4.37 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 129.369 3.067 . . . . 0.0 110.742 174.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -69.59 -36.44 76.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.623 1.569 . . . . 0.0 109.473 -172.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 82.9 mt -62.34 -39.49 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.648 0.779 . . . . 0.0 109.131 170.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.21 -55.13 25.87 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 124.747 1.165 . . . . 0.0 111.879 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 50.5 t -61.44 -41.88 91.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.311 1.055 . . . . 0.0 110.51 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.1 mt -62.14 -49.27 76.53 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 118.818 0.735 . . . . 0.0 111.055 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.53 93.2 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.429 0.292 . . . . 0.0 110.967 175.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.85 -32.91 85.75 Favored Glycine 0 C--O 1.222 -0.654 0 CA-C-O 119.07 -0.85 . . . . 0.0 111.634 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.57 -30.48 71.22 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 120.342 2.071 . . . . 0.0 112.496 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.16 -26.17 68.41 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 118.916 -0.564 . . . . 0.0 111.384 175.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 44.6 mm -131.18 99.93 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 C-N-CA 126.208 1.803 . . . . 0.0 106.854 -165.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.278 1.5 p 57.24 56.32 7.77 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.808 174.086 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -59.14 -38.33 87.15 Favored 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 123.82 3.014 . . . . 0.0 110.185 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -63.14 -46.08 88.92 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 123.997 0.919 . . . . 0.0 110.906 -176.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -57.19 -46.1 83.13 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 172.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.21 -50.35 70.63 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 106.463 -1.681 . . . . 0.0 106.463 -172.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HE2' ' CZ ' ' A' ' 130' ' ' TYR . 94.8 mttt -63.53 -40.33 96.76 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 125.372 1.469 . . . . 0.0 111.565 -178.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -57.06 -40.48 76.91 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.948 1.249 . . . . 0.0 110.603 175.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -81.03 -39.12 26.32 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 117.2 -1.381 . . . . 0.0 111.141 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 28.3 mm -57.45 -47.0 85.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 121.207 1.821 . . . . 0.0 108.73 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.69 -5.86 9.78 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -176.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.68 15.63 8.75 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.377 1.471 . . . . 0.0 112.495 173.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 66.44 6.7 4.5 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.043 1.737 . . . . 0.0 113.985 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.64 -13.67 56.07 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 120.446 -1.409 . . . . 0.0 112.235 -159.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.92 114.97 27.84 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.704 0.684 . . . . 0.0 110.728 -158.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 38.3 t -95.96 164.46 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 125.137 1.375 . . . . 0.0 108.601 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -143.49 138.28 29.11 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 128.977 2.911 . . . . 0.0 105.343 -176.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -157.68 177.58 34.4 Favored Glycine 0 C--N 1.333 0.407 0 CA-C-N 118.313 0.506 . . . . 0.0 112.346 173.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 15.7 mm -101.4 140.17 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.15 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 164.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.0 t -44.46 -64.54 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 C-N-CA 127.204 2.201 . . . . 0.0 111.469 176.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.4 mttt 57.57 165.53 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.065 1.746 . . . . 0.0 112.037 -170.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -76.69 -11.39 18.5 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 121.714 1.609 . . . . 0.0 112.832 176.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.3 m -97.12 23.93 6.85 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.423 1.489 . . . . 0.0 112.788 -163.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -139.94 -164.88 1.78 Allowed 'General case' 0 C--O 1.241 0.607 0 C-N-CA 127.176 2.191 . . . . 0.0 106.653 176.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 24.8 m -125.45 98.02 5.43 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 120.472 -1.392 . . . . 0.0 109.525 -166.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.2 m -137.57 157.73 73.21 Favored Pre-proline 0 C--O 1.241 0.645 0 C-N-CA 124.002 0.921 . . . . 0.0 113.054 -166.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.3 171.26 10.65 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.621 2.881 . . . . 0.0 110.602 171.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.32 158.19 34.43 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 121.594 -0.691 . . . . 0.0 111.735 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.49 31.32 63.26 Favored Glycine 0 CA--C 1.526 0.744 0 C-N-CA 124.009 0.814 . . . . 0.0 113.01 167.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.6 m -132.94 26.03 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 124.552 1.141 . . . . 0.0 110.317 174.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.97 -10.79 23.46 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 -154.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -151.39 31.76 0.59 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.863 2.065 . . . . 0.0 108.58 174.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -75.11 153.24 38.39 Favored 'General case' 0 C--O 1.232 0.151 0 O-C-N 120.919 -1.113 . . . . 0.0 108.49 173.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.2 m -72.83 154.48 40.6 Favored 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 123.712 0.805 . . . . 0.0 109.014 156.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -138.48 165.95 25.52 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.594 1.158 . . . . 0.0 109.823 167.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.3 mt -140.47 125.78 18.78 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 127.288 2.235 . . . . 0.0 105.504 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -148.23 150.94 13.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 174.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.66 159.26 17.21 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.784 0.802 . . . . 0.0 109.976 178.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.08 -18.03 63.94 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.199 1.0 . . . . 0.0 113.255 -168.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -102.97 -32.25 9.83 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 123.305 0.642 . . . . 0.0 111.536 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.97 9.65 0.52 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 129.038 2.935 . . . . 0.0 112.65 -176.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -56.41 -26.11 52.29 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.611 1.55 . . . . 0.0 113.618 -158.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.83 -5.88 19.43 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.695 1.589 . . . . 0.0 113.66 174.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.53 -93.64 0.88 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.852 1.215 . . . . 0.0 111.75 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.95 171.05 9.56 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.549 0.74 . . . . 0.0 110.133 -170.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tt -173.58 158.65 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 126.494 1.918 . . . . 0.0 106.944 162.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 22.8 mt -134.86 142.53 40.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 166.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -115.38 154.34 29.38 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.974 1.31 . . . . 0.0 108.541 174.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -158.65 148.1 19.19 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 125.349 1.459 . . . . 0.0 108.252 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -140.48 138.17 34.42 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 168.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -89.52 134.96 33.87 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 172.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -130.29 88.15 2.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 127.248 2.219 . . . . 0.0 108.658 174.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.69 -82.5 0.3 Allowed Glycine 0 C--N 1.336 0.541 0 C-N-CA 125.235 1.398 . . . . 0.0 113.078 170.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -123.79 9.93 8.91 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 126.815 2.046 . . . . 0.0 110.95 178.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.7 m -124.14 157.11 35.44 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.324 2.25 . . . . 0.0 108.51 -179.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 80.8 t -132.44 128.51 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.73 2.012 . . . . 0.0 105.882 168.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 20.1 mm -102.35 98.94 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 105.267 -2.123 . . . . 0.0 105.267 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.3 mt -83.44 130.67 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -134.53 91.26 2.76 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.879 1.672 . . . . 0.0 108.606 -175.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -108.48 170.36 8.07 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.807 -1.183 . . . . 0.0 111.645 -173.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.4 t -159.01 173.72 16.04 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.899 1.28 . . . . 0.0 110.152 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.9 m -121.7 12.9 10.72 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.08 2.552 . . . . 0.0 111.485 167.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -144.27 127.11 16.29 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 160.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -49.22 -39.34 29.52 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.593 0.757 . . . . 0.0 110.712 170.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -82.75 31.41 0.42 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.155 1.782 . . . . 0.0 113.628 -177.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 45.6 p -139.22 163.36 32.67 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 119.519 -1.988 . . . . 0.0 112.741 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.471 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -58.44 153.92 14.87 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.611 1.164 . . . . 0.0 110.028 169.387 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -105.54 156.17 18.48 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.259 1.424 . . . . 0.0 110.789 -169.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.17 179.04 1.66 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.834 1.254 . . . . 0.0 112.0 173.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -123.07 124.9 44.14 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.707 1.203 . . . . 0.0 109.413 168.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -144.76 105.95 4.2 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 103.911 -2.625 . . . . 0.0 103.911 168.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -118.05 109.34 16.33 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -172.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 27.0 mt -125.14 144.56 50.37 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -166.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 15.9 p -68.52 151.7 46.41 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.952 0.796 . . . . 0.0 109.834 172.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 26.8 mt -55.72 -36.0 66.75 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.426 -0.796 . . . . 0.0 111.211 168.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.4 t -61.53 -44.52 96.9 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.021 173.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.83 -60.81 2.85 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.411 1.085 . . . . 0.0 109.891 178.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 48.0 mt -55.91 -33.52 64.74 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 123.07 0.548 . . . . 0.0 111.948 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 -43.9 77.28 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.665 -0.647 . . . . 0.0 109.29 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -25.21 61.46 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.665 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.72 -66.61 0.61 Allowed 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 169.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -117.22 22.98 12.15 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.851 -1.156 . . . . 0.0 112.763 -158.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -151.06 26.55 0.71 Allowed 'General case' 0 C--O 1.239 0.542 0 O-C-N 120.744 -1.223 . . . . 0.0 112.632 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.627 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.6 OUTLIER -67.24 -59.62 3.27 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -172.514 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 17.9 p -77.81 172.03 14.07 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.016 1.327 . . . . 0.0 110.812 -171.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.83 -50.12 8.4 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 171.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -41.21 63.41 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.514 1.126 . . . . 0.0 110.92 -176.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.627 HE22 ' NE2' ' A' ' 119' ' ' GLN . 6.4 tt0 -48.17 -45.57 33.67 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.734 1.214 . . . . 0.0 111.497 178.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -59.34 -20.37 54.1 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.795 1.638 . . . . 0.0 113.49 -169.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -55.0 -70.7 0.1 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 170.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -57.57 -41.97 82.14 Favored 'General case' 0 C--O 1.222 -0.373 0 O-C-N 123.769 0.668 . . . . 0.0 111.467 -174.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 17.7 t -54.21 -59.0 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 O-C-N 123.919 0.762 . . . . 0.0 109.794 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -57.47 -34.04 68.61 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 123.169 0.293 . . . . 0.0 111.238 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -64.52 -42.15 95.95 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.961 1.304 . . . . 0.0 110.958 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . 0.408 ' CZ ' ' HE2' ' A' ' 42' ' ' LYS . 37.7 m-85 -58.78 -45.76 89.1 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.032 -1.043 . . . . 0.0 109.837 171.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 19.0 t -64.74 -31.1 52.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 O-C-N 121.844 -0.535 . . . . 0.0 110.89 179.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -84.84 -15.03 46.13 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.452 1.101 . . . . 0.0 113.181 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -96.94 -32.6 6.41 Favored Glycine 0 C--N 1.334 0.421 0 C-N-CA 124.123 0.868 . . . . 0.0 111.808 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.56 151.52 20.31 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.087 0.944 . . . . 0.0 112.177 -173.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 56.6 mtp85 -92.37 153.26 19.29 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 174.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 m -131.19 25.37 4.89 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.846 1.258 . . . . 0.0 109.635 173.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.917 2.887 . . . . 0.0 110.949 -164.141 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 . . . . . 0 CA--C 1.543 0.695 0 CA-C-O 121.684 0.754 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -122.35 152.69 39.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.548 1.539 . . . . 0.0 109.534 -175.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.59 -55.62 5.03 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 125.707 1.603 . . . . 0.0 111.354 177.039 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -44.91 -63.21 0.97 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.651 1.58 . . . . 0.0 110.359 174.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -54.65 -59.64 4.43 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.108 0.963 . . . . 0.0 109.241 -176.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 35.8 mt -56.91 -34.63 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 125.438 1.495 . . . . 0.0 110.395 -170.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.56 -28.38 71.26 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 117.958 -1.468 . . . . 0.0 114.065 -178.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 72.4 t -71.95 -40.71 68.43 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.183 0 CA-C-N 119.027 1.414 . . . . 0.0 108.635 177.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.89 -43.8 97.83 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.218 0.607 . . . . 0.0 109.71 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.88 -43.58 95.61 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.081 -0.387 . . . . 0.0 110.931 174.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.39 -30.21 75.0 Favored Glycine 0 C--O 1.222 -0.604 0 N-CA-C 110.633 -0.987 . . . . 0.0 110.633 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.9 tp -69.33 -24.0 63.86 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 120.49 -1.594 . . . . 0.0 112.018 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.85 -21.46 62.42 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.849 -0.596 . . . . 0.0 111.793 170.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.7 mm -135.52 92.89 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 C-N-CA 126.261 1.824 . . . . 0.0 107.539 -158.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 74.7 m 60.2 54.91 4.05 Favored Pre-proline 0 CA--C 1.553 1.063 0 O-C-N 121.348 -0.845 . . . . 0.0 112.176 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -60.03 -38.15 79.88 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.968 3.112 . . . . 0.0 111.796 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -55.71 -52.65 63.15 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.699 1.199 . . . . 0.0 109.68 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -61.43 -38.26 86.52 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.684 1.194 . . . . 0.0 111.054 177.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -52.89 58.17 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -62.38 -43.16 99.48 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.866 0.866 . . . . 0.0 111.743 -175.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -61.25 -44.0 97.96 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 119.248 0.931 . . . . 0.0 110.045 -176.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -69.64 -35.89 75.6 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 117.289 -1.339 . . . . 0.0 112.422 -176.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.9 mm -56.5 -53.67 37.94 Favored 'Isoleucine or valine' 0 C--N 1.339 0.149 0 CA-C-N 119.215 0.916 . . . . 0.0 109.469 168.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.75 -21.7 66.06 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -177.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.95 -8.13 58.87 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 126.752 2.021 . . . . 0.0 113.663 169.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 44.89 43.55 7.15 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.238 2.215 . . . . 0.0 110.531 -169.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -103.53 -2.13 27.26 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.407 2.283 . . . . 0.0 115.06 -177.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.13 135.06 44.38 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.011 1.324 . . . . 0.0 110.664 -160.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 71.7 t -120.4 117.45 53.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 124.462 1.105 . . . . 0.0 108.041 -175.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -80.76 152.64 28.21 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.604 1.562 . . . . 0.0 108.357 163.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -173.79 165.32 37.11 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 171.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 36.1 mm -104.06 141.7 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 170.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.1 t -44.23 -71.66 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 127.322 2.249 . . . . 0.0 114.43 -171.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.1 mptt 55.77 165.8 0.06 OUTLIER Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 125.281 1.432 . . . . 0.0 113.777 -169.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.64 -4.39 14.52 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.11 2.54 . . . . 0.0 113.86 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.32 -70.37 0.1 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.127 2.171 . . . . 0.0 112.388 -174.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.5 171.39 13.43 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.124 0.97 . . . . 0.0 109.042 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -66.04 142.03 57.95 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 165.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -152.62 158.27 33.29 Favored Pre-proline 0 C--O 1.242 0.67 0 C-N-CA 123.658 0.783 . . . . 0.0 110.176 169.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.88 178.79 3.7 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 124.34 3.36 . . . . 0.0 111.197 166.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -76.2 167.78 21.24 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.346 -0.846 . . . . 0.0 111.391 178.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.44 18.72 77.18 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 118.603 -1.11 . . . . 0.0 114.402 165.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.2 m -130.24 21.88 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 118.764 1.282 . . . . 0.0 112.402 -174.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.74 -17.27 3.26 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 118.43 2.752 . . . . 0.0 118.43 -162.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -149.57 18.91 0.93 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 127.237 2.215 . . . . 0.0 109.195 -174.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.44 ' CD1' ' HG3' ' A' ' 85' ' ' LYS . 3.1 m-85 -69.7 148.86 48.69 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 171.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.0 t -67.23 161.56 24.59 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 155.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -141.99 141.92 32.91 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.814 161.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.1 133.75 52.88 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 172.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.7 p -156.79 149.96 10.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 174.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.25 170.32 15.8 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.709 1.14 . . . . 0.0 109.578 173.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.66 -29.98 63.89 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 122.134 0.968 . . . . 0.0 112.239 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -90.96 -37.61 13.38 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 127.51 2.324 . . . . 0.0 111.889 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . 0.279 0.0 OUTLIER -91.59 30.37 1.34 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.346 0.975 . . . . 0.0 111.859 -169.536 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -45.57 -53.98 8.27 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.51 1.124 . . . . 0.0 112.878 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -86.75 6.34 31.91 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.817 1.247 . . . . 0.0 112.537 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -92.17 -106.42 1.59 Allowed Glycine 0 CA--C 1.525 0.707 0 C-N-CA 126.68 2.086 . . . . 0.0 110.91 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 39.9 m -90.0 153.61 20.46 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.261 1.425 . . . . 0.0 108.893 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tt -153.62 146.25 14.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 O-C-N 120.14 -1.6 . . . . 0.0 108.777 162.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mt -128.39 113.05 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 178.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -90.77 143.43 26.73 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -148.6 160.18 43.36 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.983 -1.073 . . . . 0.0 111.612 170.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.44 ' HG3' ' CD1' ' A' ' 68' ' ' TYR . 1.3 tmtt? -148.91 129.37 13.9 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.073 0.949 . . . . 0.0 108.951 171.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -104.82 115.27 30.02 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 124.053 0.941 . . . . 0.0 110.09 -174.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -126.41 99.24 5.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.403 2.281 . . . . 0.0 108.512 -165.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 67.21 -83.13 0.13 Allowed Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.747 1.165 . . . . 0.0 114.821 173.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -133.78 20.82 3.86 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.242 2.217 . . . . 0.0 110.752 176.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.2 146.63 45.12 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.376 1.87 . . . . 0.0 109.022 -174.184 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 96.8 t -131.72 124.53 54.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 169.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 2.8 mp -93.04 101.47 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 105.094 -2.187 . . . . 0.0 105.094 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.5 mt -92.67 121.13 43.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -121.13 96.05 4.94 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 126.742 2.017 . . . . 0.0 107.4 -175.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 34.5 p90 -113.45 168.26 9.9 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.386 -1.446 . . . . 0.0 111.421 -174.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.1 t -155.44 179.39 9.22 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.844 1.658 . . . . 0.0 107.195 177.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.2 p -122.19 2.4 9.79 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 127.056 2.143 . . . . 0.0 110.019 171.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -139.84 131.76 27.7 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-O 121.117 0.484 . . . . 0.0 111.363 164.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -3.26 3.8 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 128.486 2.715 . . . . 0.0 112.994 177.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -122.59 33.06 5.54 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.546 1.538 . . . . 0.0 110.264 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.4 p -130.43 -164.43 1.42 Allowed 'General case' 0 CA--C 1.546 0.809 0 O-C-N 120.686 -1.259 . . . . 0.0 112.695 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -100.58 154.28 18.7 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.231 1.413 . . . . 0.0 108.481 169.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -89.46 158.2 17.81 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.845 0.858 . . . . 0.0 110.354 -172.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -67.36 -178.91 0.92 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.443 1.097 . . . . 0.0 109.154 160.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -140.68 97.82 3.28 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -97.08 160.89 14.08 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 155.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -156.13 91.03 1.24 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.624 1.17 . . . . 0.0 107.857 169.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -96.34 163.45 13.07 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.611 0.764 . . . . 0.0 109.562 -178.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 40.9 p -81.46 163.01 23.05 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 166.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.37 -43.15 78.92 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 123.637 0.775 . . . . 0.0 109.007 169.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.79 -39.71 95.08 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.369 -0.824 . . . . 0.0 111.583 -176.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.8 -65.74 0.51 Allowed 'General case' 0 C--N 1.345 0.41 0 CA-C-O 118.537 -0.744 . . . . 0.0 109.321 168.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 93.9 mt -54.73 -30.74 57.03 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.221 1.009 . . . . 0.0 112.304 -174.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 59.7 tttt -66.31 -46.74 75.88 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 -7.69 58.83 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 124.609 1.163 . . . . 0.0 113.097 178.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -73.01 -66.13 0.71 Allowed 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 160.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -130.06 11.48 5.54 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 120.537 -1.352 . . . . 0.0 113.918 -154.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' TYR . . . . . 0.475 ' CZ ' ' HE2' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -140.65 22.48 2.32 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 120.796 -1.19 . . . . 0.0 111.622 179.324 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLN . . . . . 0.627 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.4 OUTLIER -73.77 -45.55 51.04 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 105.097 -2.186 . . . . 0.0 105.097 -163.19 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.8 t -91.52 150.83 21.02 Favored 'General case' 0 C--N 1.352 0.674 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -74.51 -20.34 60.01 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-O 117.327 -1.32 . . . . 0.0 112.257 177.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 4.2 t -81.24 -32.4 33.38 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 120.212 1.369 . . . . 0.0 110.932 -178.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.627 HE22 ' NE2' ' A' ' 119' ' ' GLN . 7.8 pt20 -62.29 -26.77 68.59 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.981 1.264 . . . . 0.0 111.405 -176.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.475 ' HE2' ' CZ ' ' A' ' 118' ' ' TYR . 2.6 mtpm? -47.87 -29.61 3.42 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 125.986 1.714 . . . . 0.0 113.463 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -52.67 -59.38 4.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.482 1.513 . . . . 0.0 110.26 175.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.73 -49.89 66.79 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 125.478 1.511 . . . . 0.0 110.013 -177.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 13.6 t -54.4 -54.85 18.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.405 -178.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -65.07 -25.62 67.88 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 178.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -65.41 -34.75 79.04 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.704 172.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -66.08 -34.82 78.94 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 119.963 1.256 . . . . 0.0 111.098 173.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 18.2 t -73.41 -12.01 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 O-C-N 121.558 -0.714 . . . . 0.0 111.136 177.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -121.34 22.14 10.88 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.491 1.517 . . . . 0.0 111.951 -176.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -132.86 -0.13 4.39 Favored Glycine 0 CA--C 1.528 0.9 0 O-C-N 120.876 -1.14 . . . . 0.0 112.684 174.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -76.26 -178.09 4.35 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 125.913 1.685 . . . . 0.0 111.632 173.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.1 mtt-85 -130.62 166.43 20.69 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 126.33 1.852 . . . . 0.0 107.013 164.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.3 m -122.73 -0.51 9.1 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 124.295 1.038 . . . . 0.0 111.013 177.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 C--O 1.246 0.884 0 CA-C-O 115.198 -2.334 . . . . 0.0 107.595 -149.151 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.811 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 45.0 28.36 0.36 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.988 1.715 . . . . 0.0 113.967 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 14.6 ptt? -96.26 -164.38 1.15 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.305 1.842 . . . . 0.0 110.794 -165.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -131.91 -178.94 5.11 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 161.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 58.41 -173.26 0.09 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.061 1.745 . . . . 0.0 109.173 -175.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 p -131.22 152.39 50.55 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.182 1.393 . . . . 0.0 107.29 168.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -59.33 -42.89 92.53 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 124.357 1.063 . . . . 0.0 109.769 -173.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -45.12 -47.64 12.12 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.019 1.728 . . . . 0.0 111.998 172.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -73.84 -28.71 61.74 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.685 1.194 . . . . 0.0 111.846 -174.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 71.4 mt -83.15 -34.12 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 125.018 1.327 . . . . 0.0 110.11 -176.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.59 -36.78 93.7 Favored Glycine 0 C--N 1.336 0.538 0 CA-C-N 118.997 0.817 . . . . 0.0 112.157 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.7 t -56.81 -47.8 82.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 CA-C-N 117.474 0.637 . . . . 0.0 109.972 175.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 mp -60.02 -46.77 88.39 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.688 0.676 . . . . 0.0 109.27 177.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.7 -25.5 68.23 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.89 -24.31 10.77 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 119.059 0.845 . . . . 0.0 112.225 176.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mp -62.68 -28.14 69.73 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.067 1.933 . . . . 0.0 110.391 165.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.59 -24.0 61.03 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.094 1.358 . . . . 0.0 113.289 172.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.7 mm -142.38 93.12 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 125.255 1.422 . . . . 0.0 107.428 -166.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.83 65.49 1.0 Allowed Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 125.783 1.633 . . . . 0.0 111.282 -176.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -60.98 -33.28 92.54 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.3 2.667 . . . . 0.0 111.643 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -71.25 -40.86 70.75 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.582 0.753 . . . . 0.0 109.343 -176.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 44.7 t90 -64.54 -37.52 87.84 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 121.985 -0.447 . . . . 0.0 111.22 173.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.78 -49.86 76.06 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 120.998 -1.064 . . . . 0.0 108.682 173.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -59.62 -48.04 83.22 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 116.879 -1.534 . . . . 0.0 113.161 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.63 -38.95 75.86 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.167 1.349 . . . . 0.0 111.157 -176.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -75.64 -48.5 21.87 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.65 1.18 . . . . 0.0 110.732 -176.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.3 mm -59.62 -32.03 48.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 119.419 1.009 . . . . 0.0 111.151 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.7 -39.04 70.48 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.458 1.026 . . . . 0.0 111.329 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -110.11 19.81 18.56 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.851 1.26 . . . . 0.0 111.758 176.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.78 14.54 3.27 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 120.247 -1.533 . . . . 0.0 113.808 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -69.94 -6.61 34.22 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.529 1.932 . . . . 0.0 113.422 -171.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.3 tp -86.01 131.01 34.37 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.086 1.354 . . . . 0.0 108.275 -172.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 98.8 t -106.44 131.07 57.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 171.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -94.09 116.36 28.77 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 161.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -144.3 164.06 27.7 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 171.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 22.8 mm -101.62 140.99 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -177.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 31.1 t -51.7 -73.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 125.876 1.67 . . . . 0.0 110.927 175.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? 56.62 166.01 0.06 OUTLIER Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 125.728 1.611 . . . . 0.0 112.84 -168.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -70.34 75.85 1.42 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 121.746 1.631 . . . . 0.0 109.061 160.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.1 t -130.51 -56.02 1.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.053 1.341 . . . . 0.0 110.986 -167.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -130.46 176.14 8.39 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.194 0.998 . . . . 0.0 108.625 -171.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.5 m -57.92 113.95 2.11 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.594 0.758 . . . . 0.0 109.814 171.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 6.1 m -137.98 159.34 68.89 Favored Pre-proline 0 C--O 1.239 0.521 0 O-C-N 121.965 -0.459 . . . . 0.0 110.236 174.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -72.26 175.64 9.68 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 123.578 2.852 . . . . 0.0 111.475 169.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.26 152.19 43.53 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 123.867 0.867 . . . . 0.0 111.34 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.65 28.93 33.87 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.856 -0.969 . . . . 0.0 114.483 162.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.0 m -140.52 28.68 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 124.405 1.082 . . . . 0.0 111.203 -174.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -64.0 -16.16 60.99 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 -153.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -151.51 29.14 0.62 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 127.609 2.363 . . . . 0.0 108.496 173.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -71.46 148.31 46.97 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 172.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.415 ' HB2' ' CE1' ' A' ' 84' ' ' PHE . 0.0 OUTLIER -77.97 142.49 38.29 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 166.01 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -128.06 135.31 49.66 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.874 0.87 . . . . 0.0 109.412 170.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.23 131.39 46.2 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 172.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.5 p -151.39 166.66 1.95 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 172.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -95.01 156.26 16.39 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 165.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.41 -16.14 53.21 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -113.21 -2.01 14.2 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.77 1.228 . . . . 0.0 111.978 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -110.43 22.77 15.09 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.373 1.069 . . . . 0.0 110.08 -170.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -44.88 -63.95 0.81 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.267 1.027 . . . . 0.0 111.154 -174.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -82.75 -16.65 47.16 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.796 0.438 . . . . 0.0 110.196 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -54.76 -80.22 0.08 OUTLIER Glycine 0 CA--C 1.527 0.81 0 C-N-CA 127.994 2.711 . . . . 0.0 113.82 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -148.45 148.78 30.66 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.208 1.004 . . . . 0.0 108.683 -176.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 3.7 tt -150.67 148.49 15.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-N 119.175 0.898 . . . . 0.0 109.225 -177.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 50.1 mt -134.85 110.01 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 N-CA-C 107.823 -1.176 . . . . 0.0 107.823 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -85.83 146.62 26.67 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 169.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.415 ' CE1' ' HB2' ' A' ' 69' ' ' SER . 26.3 p90 -149.59 164.47 35.03 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.626 -1.296 . . . . 0.0 110.152 167.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.65 124.31 4.94 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 167.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.84 124.89 28.68 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 161.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -123.21 115.51 21.87 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 166.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 70.24 -96.77 0.56 Allowed Glycine 0 CA--C 1.523 0.575 0 C-N-CA 124.102 0.858 . . . . 0.0 112.817 175.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -136.29 21.31 3.19 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.572 1.949 . . . . 0.0 110.364 -177.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.0 m -125.97 149.28 48.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.63 1.572 . . . . 0.0 107.368 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 60.0 t -122.41 130.54 74.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.376 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 166.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 1.1 mp -106.66 92.82 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 176.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.6 mt -77.87 129.91 36.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -131.06 98.12 4.49 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 125.535 1.534 . . . . 0.0 107.089 -174.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -124.15 164.65 19.04 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.613 -1.305 . . . . 0.0 110.461 -168.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.1 t -156.49 160.51 39.61 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.121 0.568 . . . . 0.0 109.64 174.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.9 p -108.7 8.2 26.78 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.17 1.788 . . . . 0.0 110.987 171.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -152.63 101.97 2.68 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 127.148 2.179 . . . . 0.0 106.711 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 tpt180 -44.26 -50.61 8.84 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 130.92 3.688 . . . . 0.0 110.594 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.35 3.5 8.94 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -176.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.0 p -119.85 165.52 14.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.849 0.356 . . . . 0.0 110.903 171.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.404 ' HE2' ' O ' ' A' ' 103' ' ' LEU . 10.5 ptmt -65.49 173.28 2.77 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 122.669 1.223 . . . . 0.0 111.379 -177.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.404 ' O ' ' HE2' ' A' ' 102' ' ' LYS . 2.9 mm? -82.3 153.49 25.8 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.84 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.68 -179.7 1.86 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.855 0.862 . . . . 0.0 109.024 156.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -138.61 120.0 14.86 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.559 1.144 . . . . 0.0 108.211 169.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 mttm -112.08 106.27 14.86 Favored 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 158.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -84.06 135.48 34.4 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 160.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -134.48 158.17 44.62 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.774 1.63 . . . . 0.0 106.763 169.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.9 p -69.42 155.13 40.95 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.634 161.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.0 mt -58.4 -30.54 66.92 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.703 -0.623 . . . . 0.0 111.313 169.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.0 t -64.76 -44.05 91.33 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 117.323 -1.322 . . . . 0.0 111.447 173.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -57.08 10.37 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 120.053 1.297 . . . . 0.0 109.561 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 16.0 mt -58.49 -44.85 89.54 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.314 1.445 . . . . 0.0 111.156 -179.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -61.22 -38.69 87.51 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.529 -0.732 . . . . 0.0 110.944 177.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -81.74 -19.25 41.79 Favored 'General case' 0 C--O 1.223 -0.329 0 O-C-N 120.463 -1.398 . . . . 0.0 111.127 -175.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -79.03 -50.64 10.76 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.544 1.138 . . . . 0.0 111.328 171.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -123.03 18.1 10.04 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 121.16 -0.962 . . . . 0.0 112.608 -165.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.428 ' CZ ' ' HE2' ' A' ' 124' ' ' LYS . 2.9 t80 -148.39 30.99 0.83 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 120.535 -1.353 . . . . 0.0 110.066 175.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.625 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.4 OUTLIER -63.97 -65.2 0.71 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 -176.065 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.5 p -75.89 175.77 8.46 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.617 0.767 . . . . 0.0 111.285 -169.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -42.38 11.98 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 121.116 -0.99 . . . . 0.0 110.235 173.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.2 m -57.77 -39.84 78.4 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-N 118.923 0.783 . . . . 0.0 111.374 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.625 HE22 ' NE2' ' A' ' 119' ' ' GLN . 7.8 tt0 -58.65 -25.54 62.87 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.225 1.01 . . . . 0.0 111.976 -178.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.428 ' HE2' ' CZ ' ' A' ' 118' ' ' TYR . 7.7 mtpt -63.47 -21.26 66.21 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.532 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -65.35 -64.3 0.89 Allowed 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 167.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -48.74 76.38 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 123.405 0.682 . . . . 0.0 112.254 -168.699 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.12 -54.04 31.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -66.13 -18.25 65.23 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -75.25 -44.08 48.01 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 125.461 1.504 . . . . 0.0 109.735 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -59.67 -32.02 70.1 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.848 0.859 . . . . 0.0 110.07 171.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 38.8 t -69.96 -20.53 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 O-C-N 120.654 -1.279 . . . . 0.0 111.977 172.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -118.39 20.98 12.88 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.92 1.288 . . . . 0.0 111.438 -173.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -134.75 18.41 4.08 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 127.315 2.388 . . . . 0.0 110.857 169.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -90.55 164.95 14.03 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 123.976 0.911 . . . . 0.0 110.151 169.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.47 165.36 11.08 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.719 1.608 . . . . 0.0 107.157 162.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -136.15 -4.96 2.12 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 124.519 1.127 . . . . 0.0 111.776 -167.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 . . . . . 0 C--O 1.247 0.931 0 C-N-CA 131.246 3.818 . . . . 0.0 102.638 -172.585 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.458 0 N-CA-C 112.005 -0.438 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 44.74 56.43 5.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 127.459 2.304 . . . . 0.0 112.608 171.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.22 146.4 27.59 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 177.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.12 168.61 0.14 Allowed 'General case' 0 C--O 1.238 0.49 0 C-N-CA 125.136 1.374 . . . . 0.0 109.6 -158.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -77.53 170.79 15.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -178.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 p -121.09 162.62 19.72 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 161.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -62.7 -35.13 78.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.561 0.696 . . . . 0.0 110.3 -165.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -43.3 95.27 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.486 1.115 . . . . 0.0 110.59 177.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -58.68 -47.52 84.22 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.836 0.854 . . . . 0.0 108.748 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 88.0 mt -65.07 -41.9 93.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 123.722 0.809 . . . . 0.0 109.371 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.65 -43.75 91.31 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 123.657 0.646 . . . . 0.0 112.667 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.9 t -60.76 -51.62 71.07 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 C-N-CA 123.493 0.717 . . . . 0.0 109.34 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.3 -33.39 75.4 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.532 1.06 . . . . 0.0 111.76 -175.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.1 95.23 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 122.835 0.454 . . . . 0.0 110.033 173.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.84 7.09 44.4 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-O 118.445 -1.197 . . . . 0.0 113.091 173.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -100.8 -8.9 22.23 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 119.788 1.794 . . . . 0.0 111.753 162.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -98.99 -10.03 23.21 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.157 0.983 . . . . 0.0 113.414 173.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.5 mm -139.73 93.61 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 129.684 3.194 . . . . 0.0 107.484 -172.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 63.01 73.42 0.51 Allowed Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -78.86 -30.31 2.94 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.439 2.093 . . . . 0.0 111.588 -171.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.51 -44.22 91.6 Favored 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 125.391 1.476 . . . . 0.0 109.743 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 63.9 t90 -52.37 -62.54 1.58 Allowed 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 125.172 1.389 . . . . 0.0 110.093 168.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.0 tt -52.16 -51.94 54.9 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 118.704 0.684 . . . . 0.0 111.471 -175.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.1 mttm -59.25 -44.92 92.36 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.343 -0.837 . . . . 0.0 111.413 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -60.98 -45.48 94.61 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.633 1.106 . . . . 0.0 110.631 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -58.26 -42.88 87.4 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 29.6 mm -64.78 -46.11 93.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 118.741 0.7 . . . . 0.0 110.178 176.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.36 -20.27 53.41 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.618 1.099 . . . . 0.0 112.311 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -102.16 1.14 35.73 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.623 1.569 . . . . 0.0 112.623 174.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 44.95 33.96 1.14 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.497 2.319 . . . . 0.0 111.14 -170.567 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -88.97 -18.08 28.16 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.802 2.041 . . . . 0.0 112.976 -173.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.88 130.5 37.67 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.484 1.514 . . . . 0.0 109.458 -163.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 55.6 t -108.52 156.9 8.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-O 122.955 1.359 . . . . 0.0 108.215 172.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -126.96 138.37 53.26 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.516 2.326 . . . . 0.0 105.249 176.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -161.62 -178.84 35.89 Favored Glycine 0 N--CA 1.445 -0.724 0 CA-C-O 122.241 0.912 . . . . 0.0 112.428 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.4 mm -124.48 134.85 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 C-N-CA 129.161 2.984 . . . . 0.0 104.73 -173.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.3 t -44.73 -53.96 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 C-N-CA 124.104 0.962 . . . . 0.0 113.287 -176.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.9 mmtt 65.16 156.31 0.12 Allowed Pre-proline 0 CA--C 1.532 0.257 0 C-N-CA 129.213 3.005 . . . . 0.0 111.09 -171.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.96 -3.11 7.74 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 124.103 3.202 . . . . 0.0 113.897 -176.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -120.02 -2.41 10.25 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.796 -1.19 . . . . 0.0 113.904 -162.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -89.58 173.01 8.55 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 120.814 1.643 . . . . 0.0 113.471 -170.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.6 t -76.33 35.75 0.15 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 129.51 3.124 . . . . 0.0 112.682 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.5 m -90.33 151.87 45.0 Favored Pre-proline 0 CA--C 1.536 0.441 0 O-C-N 120.675 -1.266 . . . . 0.0 113.502 -163.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.0 158.11 56.21 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.398 2.732 . . . . 0.0 110.278 176.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.93 144.27 56.33 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 123.393 0.677 . . . . 0.0 109.479 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.85 20.89 45.04 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-N 119.164 0.893 . . . . 0.0 113.429 176.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.4 m -140.29 90.81 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 104.308 -2.479 . . . . 0.0 104.308 166.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -92.42 -15.89 26.61 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -169.7 46.37 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.999 1.72 . . . . 0.0 110.956 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -94.9 114.96 26.87 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 162.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.83 154.41 7.18 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.439 1.018 . . . . 0.0 110.424 173.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 38.7 p90 -130.78 153.74 48.74 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.326 0.651 . . . . 0.0 110.447 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -119.1 134.45 55.19 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 126.767 2.027 . . . . 0.0 106.573 170.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.6 p -147.89 158.42 8.38 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 N-CA-C 104.722 -2.325 . . . . 0.0 104.722 171.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.75 164.6 17.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.931 1.241 . . . . 0.0 107.905 168.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.63 0.4 26.6 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 121.354 -0.841 . . . . 0.0 112.807 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -137.87 4.03 2.51 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.492 1.042 . . . . 0.0 112.678 -168.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -128.31 34.0 4.62 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.483 1.913 . . . . 0.0 109.569 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -56.79 -13.38 2.51 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -163.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.42 7.06 7.67 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 121.064 1.756 . . . . 0.0 111.893 174.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -82.38 -71.28 1.31 Allowed Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 126.494 1.997 . . . . 0.0 110.065 -178.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.8 m -118.79 171.13 8.43 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 117.981 0.891 . . . . 0.0 109.462 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.0 tt -168.32 148.52 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.521 0 C-N-CA 126.958 2.103 . . . . 0.0 106.945 158.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 73.5 mt -132.58 131.2 60.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.106 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 173.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -105.52 151.5 24.22 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 125.583 1.553 . . . . 0.0 108.69 172.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -144.08 156.93 44.56 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.678 1.191 . . . . 0.0 108.783 170.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.0 tttt -144.91 134.53 23.36 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 161.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.41 123.22 21.24 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 159.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -99.09 23.16 9.38 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.013 0.925 . . . . 0.0 109.037 165.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 76.8 115.08 0.14 Allowed Glycine 0 C--N 1.34 0.772 0 C-N-CA 125.963 1.744 . . . . 0.0 110.821 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 61.54 0.77 0.5 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.718 1.607 . . . . 0.0 113.645 -173.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.41 149.78 38.13 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.556 2.342 . . . . 0.0 106.628 177.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.78 129.57 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 172.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 19.4 mm -100.09 112.96 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 174.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.5 mt -101.43 118.07 47.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -116.72 104.99 11.91 Favored 'General case' 0 C--O 1.223 -0.306 0 C-N-CA 126.936 2.094 . . . . 0.0 107.17 -172.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 40.1 p90 -125.79 169.71 12.33 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.164 -1.585 . . . . 0.0 110.761 -177.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.1 t -151.26 168.7 23.94 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.149 1.38 . . . . 0.0 108.317 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.9 p -88.65 -12.73 41.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.664 1.185 . . . . 0.0 113.178 167.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -150.1 137.36 19.64 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.55 0.74 . . . . 0.0 109.771 -174.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -60.14 -21.03 61.11 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.577 1.551 . . . . 0.0 112.04 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -94.47 2.4 55.73 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.6 p -121.88 156.35 33.5 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.352 0.978 . . . . 0.0 112.771 -172.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.2 tmtt? -64.4 135.62 56.3 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 124.63 1.172 . . . . 0.0 109.819 -169.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 83.4 mt -72.81 143.9 47.71 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 123.984 0.914 . . . . 0.0 109.763 -176.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -71.24 -171.69 0.62 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.226 1.41 . . . . 0.0 109.439 171.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.93 103.91 4.09 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.114 -0.991 . . . . 0.0 110.172 170.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -85.3 147.53 26.5 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 106.147 -1.797 . . . . 0.0 106.147 147.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -137.5 127.31 25.53 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 168.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.4 mt -141.67 139.26 32.94 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -168.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 16.9 p -69.28 154.64 41.71 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.319 0.963 . . . . 0.0 109.873 173.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 20.4 mt -59.45 -28.54 67.08 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.314 -0.866 . . . . 0.0 110.046 168.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.46 -29.94 65.44 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.81 -0.556 . . . . 0.0 112.329 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.11 -59.84 2.66 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 105.856 -1.905 . . . . 0.0 105.856 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.61 -37.08 72.67 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.76 1.224 . . . . 0.0 113.138 -175.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -70.57 -31.75 68.89 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.49 -0.756 . . . . 0.0 110.21 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -63.02 1.14 Allowed 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 174.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -46.88 -53.55 11.89 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.315 1.446 . . . . 0.0 111.59 -173.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -119.14 11.46 12.38 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 121.827 -0.546 . . . . 0.0 111.953 -163.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -149.44 34.85 0.71 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.637 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -81.08 -40.33 24.29 Favored 'General case' 0 C--N 1.342 0.278 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.334 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 16.6 p -89.02 -178.84 5.79 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.899 1.681 . . . . 0.0 110.543 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 -88.45 -45.41 9.98 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 120.994 -1.066 . . . . 0.0 109.314 170.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 37.3 p -66.63 -30.27 70.51 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.301 0.955 . . . . 0.0 111.213 -175.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.637 HE22 ' NE2' ' A' ' 119' ' ' GLN . 12.0 tt0 -58.43 -30.96 67.31 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.256 0.934 . . . . 0.0 110.618 176.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -59.76 -27.22 66.34 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 121.612 -0.68 . . . . 0.0 111.78 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.18 -50.23 61.76 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.045 1.338 . . . . 0.0 108.853 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.85 -48.68 75.78 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.679 0.752 . . . . 0.0 111.815 176.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 54.8 t -53.98 -54.48 20.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.382 -177.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -63.79 -24.99 67.98 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 177.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -64.08 -43.66 94.73 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.852 0.751 . . . . 0.0 110.244 171.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -60.05 -37.07 78.75 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.619 1.099 . . . . 0.0 110.418 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 22.0 t -71.05 -8.85 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 123.626 0.77 . . . . 0.0 111.61 178.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -117.57 -14.53 10.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.741 1.216 . . . . 0.0 113.376 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -97.86 -5.37 57.54 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 125.793 1.663 . . . . 0.0 112.716 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -68.32 170.95 7.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 122.205 1.002 . . . . 0.0 110.352 165.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -127.49 174.43 9.03 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 126.927 2.091 . . . . 0.0 107.357 172.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.9 m -149.0 16.97 0.96 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.674 1.125 . . . . 0.0 112.722 -171.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 C--O 1.252 1.222 0 C-N-CA 125.732 1.613 . . . . 0.0 108.918 -171.243 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.838 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 42.9 t-80 44.45 96.04 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 128.581 2.752 . . . . 0.0 116.031 174.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -153.99 177.64 10.83 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 123.594 0.758 . . . . 0.0 111.325 171.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -134.24 93.6 3.1 Favored 'General case' 0 C--N 1.341 0.218 0 C-N-CA 126.387 1.875 . . . . 0.0 106.353 173.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 12.0 m-30 52.68 -168.76 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.565 1.546 . . . . 0.0 111.3 -168.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -138.66 150.73 46.53 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 129.313 3.045 . . . . 0.0 107.972 177.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -51.07 -40.95 59.53 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.978 0.911 . . . . 0.0 110.188 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -53.19 -59.47 4.52 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.459 1.503 . . . . 0.0 112.52 174.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -63.46 -26.16 68.6 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.608 1.563 . . . . 0.0 111.407 -175.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 93.1 mt -78.55 -40.62 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 C-N-CA 125.184 1.394 . . . . 0.0 109.742 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.7 -40.66 89.03 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 124.679 1.133 . . . . 0.0 112.431 -175.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.8 t -66.29 -49.37 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.3 mp -54.05 -49.6 68.64 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.202 0.91 . . . . 0.0 110.68 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.6 -38.01 86.04 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.1 0.56 . . . . 0.0 111.248 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.88 -32.58 73.82 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 111.81 -0.516 . . . . 0.0 111.81 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.0 mt -64.94 -23.32 67.19 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 120.468 -1.607 . . . . 0.0 111.671 176.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.98 -17.59 52.51 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.358 -0.839 . . . . 0.0 112.96 171.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mp -134.52 97.73 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 125.797 1.639 . . . . 0.0 107.428 -172.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.92 54.96 1.25 Allowed Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.02 0.928 . . . . 0.0 110.605 175.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -56.05 -39.57 90.39 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 123.262 2.641 . . . . 0.0 111.246 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -67.34 -34.4 77.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.803 1.241 . . . . 0.0 112.527 -175.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 34.9 t90 -63.68 -54.33 37.22 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 173.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 tt -50.96 -48.4 61.01 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.158 0.583 . . . . 0.0 110.748 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -59.32 -47.42 85.48 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.904 0.882 . . . . 0.0 111.306 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -58.58 -40.21 82.51 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 120.779 1.627 . . . . 0.0 112.346 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -67.01 -45.02 78.85 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.991 0.9 . . . . 0.0 109.205 -177.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 96.1 mt -71.8 -32.32 44.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 O-C-N 121.422 -0.799 . . . . 0.0 109.52 -178.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.83 -4.17 33.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.88 0.872 . . . . 0.0 112.581 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.0 -16.24 26.79 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.134 0.879 . . . . 0.0 111.673 160.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 68.83 30.26 4.81 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 127.829 2.452 . . . . 0.0 109.287 -170.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -94.96 -89.15 0.24 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 119.023 -0.513 . . . . 0.0 109.66 178.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . 0.314 13.0 tp 40.9 97.28 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 129.592 3.157 . . . . 0.0 113.921 175.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.9 t -96.14 143.51 12.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 120.096 1.316 . . . . 0.0 109.003 -177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -119.65 137.35 53.94 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 128.139 2.576 . . . . 0.0 107.831 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.15 174.77 32.56 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 176.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.6 mm -116.99 146.2 21.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 172.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.5 t -49.91 -77.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 126.299 1.84 . . . . 0.0 110.755 176.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.6 mttt 57.47 165.81 0.07 OUTLIER Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 125.833 1.653 . . . . 0.0 111.77 -165.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -75.46 -32.85 4.57 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 CA-C-N 120.332 1.154 . . . . 0.0 112.777 -176.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 47.2 t -80.11 67.55 5.96 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.061 1.345 . . . . 0.0 109.043 -177.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -157.2 -167.19 2.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.033 1.733 . . . . 0.0 107.29 159.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.2 m -109.85 105.13 14.21 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 120.238 1.381 . . . . 0.0 107.622 174.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -138.08 159.21 69.25 Favored Pre-proline 0 C--O 1.237 0.446 0 CA-C-N 118.995 0.816 . . . . 0.0 112.709 -171.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -72.86 164.38 35.73 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.467 2.778 . . . . 0.0 111.263 173.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.52 137.68 58.31 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.581 169.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.2 31.42 11.9 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-O 119.392 -0.671 . . . . 0.0 113.725 164.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 13.9 m -135.74 22.72 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-N 118.549 1.175 . . . . 0.0 109.988 171.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -63.27 -9.59 12.26 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 116.928 2.196 . . . . 0.0 116.928 -150.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -147.52 26.61 1.04 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 128.703 2.801 . . . . 0.0 111.324 172.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -78.49 153.93 30.95 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.064 0.946 . . . . 0.0 109.254 176.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.2 m -76.17 151.73 36.85 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 124.499 1.12 . . . . 0.0 108.684 163.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -133.85 145.56 49.8 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 124.129 0.972 . . . . 0.0 110.375 167.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 18.6 mt -115.75 137.77 51.76 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.406 1.883 . . . . 0.0 106.213 175.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 p -149.66 167.8 2.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 104.425 -2.435 . . . . 0.0 104.425 -179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -109.75 153.59 24.12 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 120.213 -1.555 . . . . 0.0 108.326 167.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.52 3.02 12.22 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -100.33 -47.85 4.78 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 118.866 0.757 . . . . 0.0 109.977 159.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -76.58 24.91 0.14 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.138 1.775 . . . . 0.0 112.453 -174.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -56.09 -28.87 59.44 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.555 1.542 . . . . 0.0 113.683 -164.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -128.0 11.71 6.59 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 127.139 2.176 . . . . 0.0 111.174 174.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -88.18 -56.92 1.97 Allowed Glycine 0 CA--C 1.53 0.98 0 C-N-CA 125.369 1.461 . . . . 0.0 111.105 176.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 75.0 m -127.97 161.4 29.22 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.102 1.361 . . . . 0.0 108.016 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.8 tt -156.98 154.85 5.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 O-C-N 120.382 -1.449 . . . . 0.0 107.671 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 64.5 mt -135.02 150.42 29.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 169.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -124.24 158.86 31.49 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 126.977 2.111 . . . . 0.0 108.917 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -162.72 162.74 26.93 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.974 0.909 . . . . 0.0 110.1 171.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.5 131.09 10.63 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 170.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.78 150.38 24.61 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 123.957 0.785 . . . . 0.0 109.554 171.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -117.04 -3.45 11.57 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.256 1.822 . . . . 0.0 111.253 174.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 135.96 -37.19 1.93 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 124.879 1.228 . . . . 0.0 112.258 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -131.13 -59.54 0.98 Allowed 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 125.951 1.7 . . . . 0.0 107.14 166.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.4 m -73.16 143.07 47.39 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 119.604 -1.935 . . . . 0.0 110.559 -175.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 71.3 t -133.35 116.06 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 -175.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.8 mp -84.36 94.71 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.4 mt -71.24 127.94 33.8 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 171.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.9 mttt -129.01 108.34 10.32 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -129.37 168.47 16.23 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 121.133 -0.979 . . . . 0.0 109.938 -171.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.5 t -154.63 169.62 23.44 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.524 1.129 . . . . 0.0 108.778 -176.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.6 p -99.32 -14.02 19.39 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.661 0.784 . . . . 0.0 111.86 162.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -134.71 126.93 30.02 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.337 1.055 . . . . 0.0 111.556 -176.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 57.4 ttt-85 -56.59 -30.33 63.07 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 126.681 1.992 . . . . 0.0 112.579 -173.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.92 50.28 1.09 Allowed 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 124.767 1.227 . . . . 0.0 109.889 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.1 p -135.74 156.69 48.43 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.245 1.018 . . . . 0.0 108.511 164.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.33 149.17 46.38 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.247 -0.908 . . . . 0.0 111.15 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -83.89 154.54 23.37 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.983 1.313 . . . . 0.0 110.97 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -71.44 171.29 11.55 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 125.876 1.671 . . . . 0.0 111.112 171.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -114.92 117.26 30.15 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.479 1.512 . . . . 0.0 108.565 167.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.61 115.62 14.06 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 104.114 -2.55 . . . . 0.0 104.114 156.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.09 122.39 39.94 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 -172.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 35.6 mt -138.46 145.55 41.0 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.567 1.147 . . . . 0.0 108.674 -168.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 20.7 p -77.18 151.63 35.18 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.313 0.506 . . . . 0.0 110.73 175.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.3 mt -51.0 -42.08 60.11 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 122.237 1.017 . . . . 0.0 110.807 175.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -35.89 70.49 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 125.091 1.357 . . . . 0.0 111.547 -176.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -68.03 0.37 Allowed 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 126.575 1.95 . . . . 0.0 109.652 174.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.61 -38.02 71.48 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.657 1.183 . . . . 0.0 111.279 -173.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -60.32 -34.14 73.38 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.956 0.502 . . . . 0.0 112.155 176.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.27 -58.94 3.38 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 120.787 -1.195 . . . . 0.0 108.069 173.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -45.87 -57.25 4.49 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.97 2.108 . . . . 0.0 110.537 -175.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -120.49 12.81 11.66 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.041 1.336 . . . . 0.0 112.298 -163.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -147.84 28.44 0.94 Allowed 'General case' 0 C--N 1.342 0.268 0 CA-C-N 120.08 1.309 . . . . 0.0 114.19 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.592 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -68.82 -60.14 2.59 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 120.758 -1.214 . . . . 0.0 111.915 179.543 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 11.0 t -99.6 163.63 12.42 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 125.362 1.465 . . . . 0.0 109.88 -164.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 53.2 mtt-85 -80.2 -38.29 31.48 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -167.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 8.1 t -57.45 -38.63 74.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.708 0.686 . . . . 0.0 109.654 174.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.592 HE22 ' NE2' ' A' ' 119' ' ' GLN . 13.0 tt0 -62.94 -25.31 68.28 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.684 -0.635 . . . . 0.0 112.368 176.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -71.66 -12.86 61.55 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 117.511 -1.233 . . . . 0.0 111.885 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -71.19 -73.07 0.19 Allowed 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 115.993 -1.956 . . . . 0.0 106.353 162.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -47.71 -55.14 10.16 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 120.243 1.383 . . . . 0.0 112.437 -166.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 78.3 t -54.45 -50.14 60.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 123.59 0.756 . . . . 0.0 110.391 -175.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.71 -34.03 73.33 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 176.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -64.14 -31.62 72.88 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 125.816 1.646 . . . . 0.0 108.835 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -68.39 -41.42 80.56 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.348 1.459 . . . . 0.0 110.957 171.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.67 -35.14 74.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-N 119.296 0.953 . . . . 0.0 109.288 172.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -80.56 10.09 5.22 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.913 -1.117 . . . . 0.0 112.712 172.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -129.72 -5.15 4.56 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 125.954 1.74 . . . . 0.0 112.181 -172.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.0 pp -84.38 176.42 8.7 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 118.15 0.975 . . . . 0.0 110.377 167.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -138.2 163.37 31.88 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 128.7 2.8 . . . . 0.0 105.536 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.42 -5.79 15.1 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.244 1.021 . . . . 0.0 110.71 178.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 . . . . . 0 C--O 1.254 1.311 0 C-N-CA 130.169 3.387 . . . . 0.0 105.955 -177.329 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.511 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 37.3 m80 -65.99 135.67 55.01 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 158.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.52 101.79 4.91 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 105.496 -2.038 . . . . 0.0 105.496 -162.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -58.37 121.49 10.95 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -112.18 172.09 7.12 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.774 1.23 . . . . 0.0 107.793 174.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.88 152.69 49.08 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.492 1.117 . . . . 0.0 110.124 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -48.44 -41.38 29.18 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.496 1.118 . . . . 0.0 110.193 173.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -50.31 -63.58 1.08 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.406 2.282 . . . . 0.0 110.487 174.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -70.34 -32.9 70.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.835 2.054 . . . . 0.0 111.354 -172.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 88.2 mt -71.93 -33.94 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 124.613 1.165 . . . . 0.0 108.818 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.36 -46.71 63.74 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 125.157 1.361 . . . . 0.0 111.06 -174.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 65.0 t -67.84 -46.62 81.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 123.276 0.63 . . . . 0.0 109.433 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.7 mp -58.78 -51.91 67.95 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.563 0.745 . . . . 0.0 111.503 -179.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.18 86.7 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.739 -0.648 . . . . 0.0 111.198 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.61 -28.6 72.07 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 118.79 0.723 . . . . 0.0 111.956 176.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mp -65.38 -24.93 67.36 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.35 -1.676 . . . . 0.0 112.44 176.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.57 -22.42 47.16 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 118.813 -0.613 . . . . 0.0 112.611 171.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mp -130.1 92.12 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.519 1.528 . . . . 0.0 107.017 -172.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.16 63.78 1.08 Allowed Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 124.61 1.164 . . . . 0.0 111.594 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -59.31 -35.36 97.06 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.576 2.184 . . . . 0.0 111.165 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -68.86 -49.84 54.94 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.95 -175.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 59.5 t90 -52.22 -50.73 61.39 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 118.826 0.739 . . . . 0.0 109.796 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.1 tt -53.68 -59.27 4.83 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -62.86 -32.66 73.94 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 117.86 -1.067 . . . . 0.0 112.372 -175.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -63.85 -48.51 76.46 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 120.228 1.376 . . . . 0.0 108.858 176.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -65.85 -34.35 77.94 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 118.384 -0.817 . . . . 0.0 111.883 -177.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 45.1 mm -61.77 -49.72 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 119.428 1.013 . . . . 0.0 109.37 170.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.73 -3.08 4.27 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.083 0.953 . . . . 0.0 113.324 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.84 -7.07 14.21 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.645 1.978 . . . . 0.0 112.378 172.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.9 t30 44.61 38.67 2.83 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.171 2.188 . . . . 0.0 111.203 -167.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.37 -5.07 19.29 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.491 1.517 . . . . 0.0 111.438 -175.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.62 138.61 36.44 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 92.9 t -118.0 150.47 20.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 126.316 1.846 . . . . 0.0 106.784 175.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -124.82 142.83 51.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.258 3.023 . . . . 0.0 105.616 174.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -167.24 -178.95 39.88 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 27.8 mm -119.1 137.55 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 125.76 1.624 . . . . 0.0 106.83 -176.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 23.8 t -43.99 -71.98 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.725 1.21 . . . . 0.0 112.606 175.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 47.0 mttt 55.06 165.04 0.05 OUTLIER Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.708 1.603 . . . . 0.0 113.03 -164.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -78.84 -22.22 9.06 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 121.008 1.138 . . . . 0.0 111.009 175.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.9 m -77.29 19.56 0.33 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.189 1.796 . . . . 0.0 113.743 -172.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -132.8 177.89 7.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.598 1.559 . . . . 0.0 109.124 176.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.1 m -91.33 112.08 23.84 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.849 1.26 . . . . 0.0 107.902 173.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.7 m -144.47 162.23 40.37 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 123.665 0.786 . . . . 0.0 110.429 -177.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.25 -172.83 1.11 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.315 2.677 . . . . 0.0 112.211 171.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.04 162.23 28.56 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.297 1.039 . . . . 0.0 111.552 165.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.32 33.64 78.2 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 123.93 0.776 . . . . 0.0 113.514 160.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.9 m -144.14 27.15 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 118.39 1.095 . . . . 0.0 111.606 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.79 -16.35 4.34 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -163.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -149.62 15.4 0.87 Allowed 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 128.352 2.661 . . . . 0.0 110.424 -170.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -74.68 132.08 41.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.6 m -68.03 149.33 49.83 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 166.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -136.71 164.32 28.51 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.388 -0.82 . . . . 0.0 110.689 173.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 16.7 mt -139.23 135.88 34.39 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 126.968 2.107 . . . . 0.0 105.878 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 11.8 p -156.17 158.26 3.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -174.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.401 ' HB1' ' H ' ' A' ' 76' ' ' ASP . . . -84.97 154.31 22.23 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.107 -0.996 . . . . 0.0 108.391 168.165 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.49 -16.01 62.86 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.452 -0.785 . . . . 0.0 112.9 175.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -104.03 -39.19 6.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.667 173.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.401 ' H ' ' HB1' ' A' ' 73' ' ' ALA . 1.7 m-20 -82.15 28.79 0.43 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.634 1.174 . . . . 0.0 110.548 -167.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -49.71 -53.66 23.38 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 126.491 1.916 . . . . 0.0 110.534 -169.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -92.51 7.97 40.85 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.045 1.338 . . . . 0.0 113.045 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.2 -68.54 1.02 Allowed Glycine 0 CA--C 1.529 0.919 0 C-N-CA 126.263 1.887 . . . . 0.0 111.432 -176.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.7 m -134.8 143.09 46.88 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.814 1.307 . . . . 0.0 108.987 173.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.6 tt -143.44 157.89 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 171.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.2 mt -141.8 137.91 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 176.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -118.09 156.35 28.8 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 124.646 1.178 . . . . 0.0 108.64 176.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -161.02 158.47 27.94 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 120.997 -1.064 . . . . 0.0 110.593 174.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.53 110.16 4.67 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 166.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.24 124.71 32.19 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -151.87 150.79 30.48 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.307 2.243 . . . . 0.0 110.769 -177.314 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 46.42 53.4 9.66 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.872 1.225 . . . . 0.0 113.815 171.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 53.9 mm-40 57.73 12.11 1.54 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.498 1.919 . . . . 0.0 115.069 -172.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.5 m -128.08 170.23 13.17 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 128.443 2.697 . . . . 0.0 109.119 -168.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.6 p -156.05 109.59 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.689 0 O-C-N 121.003 -1.061 . . . . 0.0 112.616 174.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 1.6 mp -79.03 95.38 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 173.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 19.2 mt -76.34 128.16 37.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 165.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -118.02 110.75 18.05 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 126.366 1.866 . . . . 0.0 106.405 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 34.7 p90 -126.78 164.96 20.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.146 0.884 . . . . 0.0 112.913 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.6 t -148.75 172.03 15.26 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.958 1.703 . . . . 0.0 108.615 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.6 p -114.93 -1.41 13.13 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.729 1.612 . . . . 0.0 111.953 169.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -143.21 143.28 31.69 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 160.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.0 mtm180 -60.44 -10.87 5.46 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -101.84 1.27 36.88 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.8 p -113.24 156.36 23.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.132 0.967 . . . . 0.0 112.612 -174.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -64.68 132.69 50.39 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 125.847 1.659 . . . . 0.0 109.926 -168.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.4 mt -78.23 140.58 38.9 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -173.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -66.9 -174.33 0.32 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.676 1.19 . . . . 0.0 110.793 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.32 101.83 4.63 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.381 1.072 . . . . 0.0 108.996 178.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -121.29 113.24 19.65 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 103.81 -2.663 . . . . 0.0 103.81 174.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -126.58 106.1 9.18 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 116.319 -1.8 . . . . 0.0 108.031 -166.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 26.7 mt -128.2 154.7 45.52 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 120.71 1.595 . . . . 0.0 109.143 -158.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 22.1 p -73.79 147.21 43.62 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 121.258 1.845 . . . . 0.0 111.44 176.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.6 mt -46.7 -48.89 20.13 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 122.919 1.343 . . . . 0.0 109.77 167.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.24 -15.69 62.46 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.01 0.924 . . . . 0.0 112.281 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -75.83 -56.47 4.64 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 171.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -55.14 -37.61 67.17 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.827 1.194 . . . . 0.0 111.834 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -56.83 -47.72 79.67 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.848 -0.533 . . . . 0.0 110.293 173.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -20.37 63.37 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.164 -0.922 . . . . 0.0 112.564 -176.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -83.01 -57.47 3.27 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.532 0.733 . . . . 0.0 110.952 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -116.28 0.94 13.0 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.391 -0.818 . . . . 0.0 113.064 -163.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -138.18 26.9 2.64 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -174.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.82 -26.96 40.33 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 174.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 66.2 p -80.09 -165.54 0.86 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.187 0.903 . . . . 0.0 110.972 -168.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 24.7 ttm-85 -114.53 -33.3 5.61 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.486 1.114 . . . . 0.0 111.779 172.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.3 p -62.11 -48.09 81.72 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 126.311 1.845 . . . . 0.0 110.874 174.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -58.03 -25.79 61.6 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -172.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -65.44 -4.43 5.71 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.018 1.327 . . . . 0.0 112.774 175.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -80.08 -83.51 0.1 Allowed 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 105.255 -2.128 . . . . 0.0 105.255 154.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -55.01 -56.46 19.46 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 124.168 0.987 . . . . 0.0 113.533 -160.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.17 -21.77 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.131 0.972 . . . . 0.0 111.483 -175.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.62 -39.42 14.08 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.243 1.817 . . . . 0.0 109.924 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -59.55 -40.05 86.01 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 126.987 2.115 . . . . 0.0 110.667 174.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 17.8 m-30 -60.54 -33.08 72.14 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 125.201 1.4 . . . . 0.0 110.783 179.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 24.2 t -68.58 -13.9 17.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 O-C-N 121.583 -0.698 . . . . 0.0 110.772 175.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -116.08 17.64 15.74 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.286 1.434 . . . . 0.0 111.111 172.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -122.54 -10.61 5.91 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 126.214 1.864 . . . . 0.0 111.788 178.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.31 165.74 24.48 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.412 1.085 . . . . 0.0 108.928 157.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -110.81 162.49 14.74 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 127.426 2.29 . . . . 0.0 107.03 172.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.4 m -132.35 17.67 4.45 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.931 0.492 . . . . 0.0 110.376 176.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 . . . . . 0 C--O 1.25 1.122 0 C-N-CA 128.74 2.816 . . . . 0.0 108.15 -170.347 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.498 0 N-CA-C 109.13 -1.588 . . . . 0.0 109.13 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -58.08 -33.03 68.64 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -171.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.3 mtp 60.24 -167.34 0.18 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.362 0.665 . . . . 0.0 110.836 176.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -133.72 171.06 14.66 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 125.497 1.519 . . . . 0.0 108.619 164.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -102.07 173.13 6.52 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 124.941 1.296 . . . . 0.0 108.387 172.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 p -135.51 150.92 49.91 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 125.134 1.373 . . . . 0.0 108.585 177.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -57.35 -38.73 74.59 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.348 0.659 . . . . 0.0 110.819 -174.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -48.96 -61.28 2.14 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.465 2.306 . . . . 0.0 111.889 172.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 -66.74 -40.05 88.18 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.989 1.716 . . . . 0.0 109.456 -172.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 67.3 mt -61.89 -35.49 68.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 173.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.77 -51.05 59.31 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-O 118.187 -1.34 . . . . 0.0 111.232 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 76.3 t -58.3 -50.23 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 118.134 0.967 . . . . 0.0 109.18 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.4 mp -55.71 -49.82 71.99 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.259 1.024 . . . . 0.0 112.008 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.19 -42.78 93.25 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.919 -0.562 . . . . 0.0 111.32 -177.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.11 -25.24 74.54 Favored Glycine 0 C--N 1.337 0.629 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.095 176.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 tp -66.53 -24.15 66.34 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.307 -1.702 . . . . 0.0 111.74 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.92 -22.82 49.06 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 170.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.8 mp -136.59 101.34 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.543 1.537 . . . . 0.0 106.927 -170.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m 64.49 59.2 1.54 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.73 1.212 . . . . 0.0 112.904 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.82 -43.21 12.94 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.33 2.687 . . . . 0.0 112.165 176.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -53.74 -55.28 27.72 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.467 1.03 . . . . 0.0 110.164 -177.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 63.0 t90 -53.33 -42.17 66.46 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.61 1.164 . . . . 0.0 110.714 176.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.59 -53.6 32.67 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 -174.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -58.15 -44.22 87.74 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 123.857 0.863 . . . . 0.0 110.69 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -55.8 -52.35 64.31 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.939 0.896 . . . . 0.0 109.919 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -71.37 -24.39 62.07 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.498 -0.763 . . . . 0.0 111.482 -174.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 24.5 mm -72.18 -38.75 63.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 120.095 1.316 . . . . 0.0 110.579 167.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.09 -6.52 9.17 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.511 1.051 . . . . 0.0 112.756 -178.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.07 10.26 8.14 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.235 1.414 . . . . 0.0 112.267 167.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 50.67 27.44 2.98 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 128.78 2.832 . . . . 0.0 112.521 -178.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -82.77 -8.19 59.6 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 127.045 2.138 . . . . 0.0 112.823 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.8 tp -76.5 147.43 37.81 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.537 1.062 . . . . 0.0 110.225 -175.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.9 t -123.89 159.36 29.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 125.614 1.566 . . . . 0.0 107.782 170.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -129.65 144.54 51.33 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.669 2.787 . . . . 0.0 107.56 173.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -161.5 173.97 37.97 Favored Glycine 0 C--N 1.335 0.522 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 174.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 23.6 mm -106.3 147.77 11.42 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 168.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.7 t -50.72 -77.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 126.103 1.761 . . . . 0.0 112.346 173.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 38.3 mtmt 57.43 165.43 0.07 OUTLIER Pre-proline 0 CA--C 1.541 0.622 0 C-N-CA 126.477 1.911 . . . . 0.0 114.439 -170.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -78.83 64.62 8.76 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 123.078 2.518 . . . . 0.0 109.471 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.1 m -140.29 -17.02 0.92 Allowed 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.205 1.802 . . . . 0.0 112.728 -167.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -146.36 161.5 40.22 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 119.479 1.036 . . . . 0.0 108.985 -168.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 84.9 m -70.93 117.43 12.42 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 119.832 1.196 . . . . 0.0 107.969 173.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 30.4 m -139.96 159.37 64.76 Favored Pre-proline 0 C--O 1.236 0.352 0 C-N-CA 124.79 1.236 . . . . 0.0 109.161 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -72.13 -178.44 3.23 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 121.72 1.614 . . . . 0.0 109.882 169.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.09 163.34 28.3 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.355 169.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.79 16.83 69.33 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-O 118.201 -1.333 . . . . 0.0 114.067 166.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.2 m -141.35 19.06 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 CA-C-N 119.115 1.458 . . . . 0.0 113.427 -171.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -57.22 -12.72 2.49 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 127.101 2.16 . . . . 0.0 116.245 -167.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -142.99 14.78 1.9 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.489 1.516 . . . . 0.0 111.813 175.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -70.07 148.1 49.2 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.181 -0.949 . . . . 0.0 108.993 176.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.3 m -72.89 157.79 36.76 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 124.14 0.976 . . . . 0.0 109.779 163.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -136.21 162.17 33.72 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.645 1.178 . . . . 0.0 110.146 163.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 10.1 mt -133.98 136.44 44.13 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 171.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.5 p -154.19 -177.99 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 104.9 -2.259 . . . . 0.0 104.9 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -132.38 158.44 41.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 120.527 -1.358 . . . . 0.0 110.412 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.83 -17.26 62.75 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 125.653 1.581 . . . . 0.0 114.65 -161.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -117.41 -19.37 9.54 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.332 0.653 . . . . 0.0 111.404 175.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -88.82 38.35 0.88 Allowed 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.818 -1.176 . . . . 0.0 109.995 -178.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -50.98 -52.34 43.65 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.189 -0.944 . . . . 0.0 112.894 -167.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -95.86 2.68 53.83 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.946 0.499 . . . . 0.0 111.456 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.43 -66.66 1.96 Allowed Glycine 0 CA--C 1.527 0.833 0 C-N-CA 125.323 1.439 . . . . 0.0 112.602 -169.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.2 m -144.55 154.1 42.52 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.801 1.24 . . . . 0.0 107.707 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.6 tt -153.12 148.91 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-N 119.916 1.234 . . . . 0.0 108.161 174.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 24.0 mt -136.78 149.98 26.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 120.601 -1.312 . . . . 0.0 108.704 172.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -125.07 162.64 24.13 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 126.49 1.916 . . . . 0.0 109.369 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -162.16 160.36 27.08 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.103 -0.998 . . . . 0.0 111.777 175.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -142.88 111.34 6.21 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.907 0.883 . . . . 0.0 109.009 161.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -81.86 102.74 11.04 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 173.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -96.2 90.49 5.51 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 126.389 1.876 . . . . 0.0 106.385 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.91 -137.4 43.93 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.71 5.22 0.13 Allowed 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 116.473 -1.727 . . . . 0.0 115.187 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.0 157.21 44.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 121.657 2.026 . . . . 0.0 110.61 -175.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.4 p -137.12 118.65 18.44 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 O-C-N 120.908 -1.12 . . . . 0.0 113.552 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 13.5 mm -78.5 94.05 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 172.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 27.1 mt -67.68 125.5 25.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 164.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -121.69 95.36 4.64 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 176.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 51.3 p90 -110.11 163.71 13.33 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.563 -1.336 . . . . 0.0 111.653 -177.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -147.23 166.73 26.14 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 170.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.3 p -98.24 -12.09 21.98 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.355 1.462 . . . . 0.0 111.108 171.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -140.13 132.88 29.02 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.924 0.89 . . . . 0.0 108.714 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -55.38 -25.67 36.76 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.04 1.336 . . . . 0.0 112.208 177.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.14 -5.29 59.06 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 118.293 2.701 . . . . 0.0 118.293 -178.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.6 p -116.71 161.53 19.1 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.488 1.04 . . . . 0.0 113.774 -169.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.1 tmtt? -64.76 153.08 40.91 Favored 'General case' 0 C--N 1.346 0.419 0 C-N-CA 123.249 0.62 . . . . 0.0 109.71 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -88.01 139.58 30.37 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.211 0.529 . . . . 0.0 109.694 -174.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -61.45 174.32 0.76 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.961 0.904 . . . . 0.0 109.713 164.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -132.4 124.47 28.74 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 174.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -127.87 123.13 34.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 162.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.08 127.85 43.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 114.894 -2.479 . . . . 0.0 106.31 172.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -124.69 137.45 54.35 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 122.813 2.551 . . . . 0.0 108.479 179.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.9 p -64.6 148.43 50.87 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.213 172.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.5 mt -49.62 -42.21 44.34 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 121.35 0.595 . . . . 0.0 109.939 165.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.6 t -62.63 -45.77 91.32 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.459 -177.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -52.26 -61.02 2.54 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 118.551 0.614 . . . . 0.0 110.428 175.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.79 -32.62 72.92 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.714 0.265 . . . . 0.0 111.714 -171.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -66.12 -40.8 90.97 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.546 -0.721 . . . . 0.0 110.052 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -49.53 40.72 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 117.636 -1.173 . . . . 0.0 110.752 -177.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.16 -57.16 12.88 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.211 1.804 . . . . 0.0 108.367 177.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -118.55 16.49 13.73 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -159.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.509 ' CE1' ' HA ' ' A' ' 124' ' ' LYS . 1.5 t80 -147.21 26.59 1.07 Allowed 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -179.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.567 ' NE2' HE22 ' A' ' 123' ' ' GLN 0.272 0.0 OUTLIER -79.4 -52.96 7.39 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.891 -1.131 . . . . 0.0 113.793 -178.146 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.0 p -85.13 159.46 20.15 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.72 1.6 . . . . 0.0 111.638 -172.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -63.27 -45.05 93.3 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 116.774 -1.584 . . . . 0.0 113.932 176.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.7 t -61.49 -39.73 92.0 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 120.152 1.342 . . . . 0.0 108.815 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.567 HE22 ' NE2' ' A' ' 119' ' ' GLN . 11.7 tt0 -56.18 -39.21 72.03 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.509 ' HA ' ' CE1' ' A' ' 118' ' ' TYR . 7.0 mtpm? -58.54 -37.28 75.35 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 118.361 -0.828 . . . . 0.0 112.88 178.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -60.92 2.15 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.32 -52.79 33.75 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.253 1.421 . . . . 0.0 111.249 -177.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 91.1 t -55.67 -48.97 77.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 124.167 0.987 . . . . 0.0 111.194 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -67.12 -31.88 72.64 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.484 0.714 . . . . 0.0 111.663 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.31 -41.76 97.53 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.758 1.623 . . . . 0.0 109.913 175.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -61.01 -38.44 86.09 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 122.86 0.464 . . . . 0.0 112.102 177.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.3 t -64.07 -41.39 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.695 0.68 . . . . 0.0 109.793 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.37 -13.16 61.77 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -102.2 11.5 57.07 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.086 1.327 . . . . 0.0 113.541 -171.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.5 pp -117.22 173.17 6.83 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.108 0.963 . . . . 0.0 110.201 174.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -125.78 167.87 14.59 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 125.231 1.412 . . . . 0.0 108.174 -171.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.91 -6.12 6.18 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 122.306 1.05 . . . . 0.0 113.06 -175.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.061 1 C-N-CA 131.808 4.043 . . . . 0.0 104.983 -174.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.818 0 N-CA-C 111.511 -0.635 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.97 -14.53 4.42 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -170.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.51 91.07 2.0 Allowed 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.707 1.594 . . . . 0.0 110.485 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? 59.46 -179.02 0.09 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.067 1.747 . . . . 0.0 111.552 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 59.3 -175.06 0.1 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.926 1.691 . . . . 0.0 109.82 -166.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.31 149.51 42.2 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 165.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -62.39 -35.38 79.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.69 -163.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -43.27 92.87 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.315 0.646 . . . . 0.0 109.907 -178.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -61.32 -36.48 80.23 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 123.257 0.623 . . . . 0.0 109.75 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.5 mt -69.2 -45.4 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -59.7 -36.58 90.23 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.257 -0.746 . . . . 0.0 113.468 -175.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.75 -48.7 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 117.732 0.766 . . . . 0.0 109.501 174.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.89 -44.21 96.7 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 118.719 0.691 . . . . 0.0 110.279 -178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.62 -43.92 72.67 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.763 0.825 . . . . 0.0 109.775 175.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.99 -35.3 78.5 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.7 mp -62.62 -18.19 61.76 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.274 2.037 . . . . 0.0 112.271 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -86.23 -17.38 34.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.633 1.573 . . . . 0.0 114.072 171.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.9 mp -135.91 96.21 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 126.883 2.073 . . . . 0.0 106.902 -177.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 58.99 73.59 0.68 Allowed Pre-proline 0 CA--C 1.543 0.712 0 C-N-CA 127.59 2.356 . . . . 0.0 112.388 -178.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -60.34 -46.14 19.46 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.724 2.949 . . . . 0.0 111.916 172.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.33 -27.78 69.28 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.257 0.623 . . . . 0.0 112.042 -174.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -65.03 -65.13 0.71 Allowed 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.286 -0.884 . . . . 0.0 109.024 172.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 tt -52.16 -47.54 65.4 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.0 0.92 . . . . 0.0 110.724 -174.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -59.9 -46.94 87.74 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.65 0.78 . . . . 0.0 110.391 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -61.51 -41.7 97.7 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 119.092 0.86 . . . . 0.0 111.501 173.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -61.03 -49.07 78.88 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.788 0.722 . . . . 0.0 109.171 -176.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.5 mm -61.52 -34.35 61.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 123.938 0.895 . . . . 0.0 110.478 177.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.11 -9.01 19.28 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.933 -1.105 . . . . 0.0 112.931 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -123.46 10.7 9.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.305 1.042 . . . . 0.0 112.42 167.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 52.12 34.49 14.33 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.065 1.746 . . . . 0.0 111.938 -175.243 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -87.64 -0.64 57.16 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 126.941 2.097 . . . . 0.0 114.638 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 tp -90.69 134.51 34.36 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.371 1.068 . . . . 0.0 109.306 -171.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 53.8 t -118.63 153.53 20.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 126.062 1.745 . . . . 0.0 108.053 174.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -135.26 148.19 49.49 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 127.724 2.41 . . . . 0.0 107.451 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -163.38 173.4 39.51 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 170.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 25.4 mm -95.9 148.1 5.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 161.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.5 t -44.59 -59.19 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 C-N-CA 126.752 2.021 . . . . 0.0 113.647 178.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 mttt 58.77 165.41 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 126.348 1.859 . . . . 0.0 113.522 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -73.76 -25.29 14.73 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 121.837 1.691 . . . . 0.0 111.749 174.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.41 63.77 0.98 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.093 1.757 . . . . 0.0 110.399 -170.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -158.09 -169.23 2.73 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.482 2.313 . . . . 0.0 106.752 169.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 20.5 m -118.97 110.46 17.15 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 120.271 1.396 . . . . 0.0 108.725 172.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 31.6 m -135.44 163.09 53.32 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 124.89 1.276 . . . . 0.0 112.138 -175.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -75.61 172.86 15.5 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.111 3.207 . . . . 0.0 112.266 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.74 135.39 40.33 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.766 0.826 . . . . 0.0 111.038 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.77 45.13 6.14 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 125.326 1.441 . . . . 0.0 113.163 168.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.7 m -138.84 38.61 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 125.874 1.67 . . . . 0.0 109.392 173.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -65.47 -15.96 63.17 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -148.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -148.27 17.14 1.06 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 127.572 2.349 . . . . 0.0 111.344 175.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.46 ' CG ' ' HB2' ' A' ' 85' ' ' LYS . 3.4 m-85 -61.6 152.66 29.97 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 122.017 0.913 . . . . 0.0 109.358 177.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m -75.01 153.97 38.24 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 126.32 1.848 . . . . 0.0 108.706 165.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 33.9 p90 -137.36 163.62 30.58 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.39 1.076 . . . . 0.0 110.69 167.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.4 mt -141.83 133.05 26.35 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 127.422 2.289 . . . . 0.0 106.726 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.8 p -159.05 159.63 2.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.349 1.06 . . . . 0.0 108.672 -175.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -86.93 146.85 26.0 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 119.095 0.861 . . . . 0.0 109.905 177.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.28 -10.69 11.71 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 126.676 1.991 . . . . 0.0 114.024 176.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -136.36 -6.95 2.0 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 125.678 1.591 . . . . 0.0 113.395 -169.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -130.14 37.61 3.88 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 125.931 1.692 . . . . 0.0 107.512 179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.18 -39.3 28.85 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.332 0.653 . . . . 0.0 111.531 -173.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -90.1 -7.15 54.48 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.594 1.157 . . . . 0.0 112.574 -174.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.62 -65.86 1.39 Allowed Glycine 0 C--N 1.334 0.461 0 C-N-CA 124.426 1.012 . . . . 0.0 111.895 -167.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.99 128.04 33.57 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 -171.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.0 tt -137.58 149.36 25.45 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 45.4 mt -133.64 138.11 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 172.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -111.06 152.24 27.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 126.298 1.839 . . . . 0.0 106.828 172.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -154.11 163.43 40.11 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 121.171 -0.955 . . . . 0.0 108.821 171.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.46 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -146.94 109.81 4.68 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 173.426 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -77.06 82.36 3.57 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.417 1.087 . . . . 0.0 108.702 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -74.14 179.53 4.39 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.232 2.213 . . . . 0.0 109.32 172.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.84 117.48 6.68 Favored Glycine 0 CA--C 1.531 1.042 0 O-C-N 120.533 -1.354 . . . . 0.0 112.127 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 53.68 11.45 0.31 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.582 2.353 . . . . 0.0 114.267 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.3 m -143.78 159.33 42.7 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 120.288 1.404 . . . . 0.0 109.151 -166.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.0 t -133.82 116.73 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 167.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 2.5 mp -84.36 102.6 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 168.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.45 134.39 27.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 175.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -134.18 97.98 4.0 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.755 1.622 . . . . 0.0 108.465 -175.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 40.9 p90 -122.57 168.49 12.1 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.612 -1.305 . . . . 0.0 110.554 -172.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.9 t -153.1 167.24 29.9 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.509 1.124 . . . . 0.0 109.045 -173.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.5 p -88.77 -15.25 35.14 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.501 0.72 . . . . 0.0 112.422 166.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -150.53 147.03 26.98 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.541 0.736 . . . . 0.0 110.683 -170.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.33 11.2 0.09 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.366 1.866 . . . . 0.0 113.546 176.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.44 10.13 3.19 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 117.219 2.304 . . . . 0.0 117.219 -177.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -116.33 158.74 22.95 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.152 0.501 . . . . 0.0 110.509 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.15 131.02 42.94 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 -175.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -64.3 146.32 54.58 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.294 0.569 . . . . 0.0 110.065 -177.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -59.69 172.1 0.77 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.168 0.987 . . . . 0.0 109.936 163.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -130.23 108.24 9.88 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.188 0.995 . . . . 0.0 108.445 168.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -116.96 85.09 2.26 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 104.17 -2.53 . . . . 0.0 104.17 172.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -79.73 137.77 37.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 171.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.6 mt -143.9 147.79 34.5 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.86 149.77 39.44 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 118.432 0.56 . . . . 0.0 110.554 171.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.43 -38.07 71.07 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.658 0.783 . . . . 0.0 110.528 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.3 t -55.37 -42.59 74.14 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.794 177.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -56.59 19.49 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 123.495 0.718 . . . . 0.0 110.189 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.0 mt -55.0 -39.97 69.63 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 122.771 0.429 . . . . 0.0 111.206 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -69.95 -37.97 75.99 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.795 0.438 . . . . 0.0 110.915 -178.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -29.29 64.23 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.565 1.146 . . . . 0.0 111.156 177.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -88.83 -42.86 11.63 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 118.045 -0.978 . . . . 0.0 112.174 -169.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -133.14 14.89 4.21 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.895 0.771 . . . . 0.0 112.754 -176.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -135.83 26.95 3.32 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.637 -1.289 . . . . 0.0 112.892 177.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -93.2 -21.52 19.59 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 126.774 2.03 . . . . 0.0 113.28 -174.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.9 p -87.61 -167.74 1.99 Allowed 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 118.912 0.778 . . . . 0.0 110.324 -175.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 15.5 mmp_? -103.38 -43.31 5.46 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.72 0.808 . . . . 0.0 110.169 161.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.15 -22.65 67.02 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -175.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -65.08 -24.89 67.58 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 120.355 1.434 . . . . 0.0 110.981 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -65.9 -7.45 16.64 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 121.458 -0.776 . . . . 0.0 111.938 174.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.91 -75.86 0.24 Allowed 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 157.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -55.17 -55.6 29.38 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 113.736 1.014 . . . . 0.0 113.736 -166.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 57.8 t -58.83 -54.08 38.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 124.569 1.148 . . . . 0.0 109.754 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.27 -26.1 67.54 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -74.25 -42.56 59.46 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 125.036 1.335 . . . . 0.0 110.393 176.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -57.25 -41.7 80.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.252 0.621 . . . . 0.0 110.205 172.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 25.7 t -70.88 -30.12 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 O-C-N 121.175 -0.953 . . . . 0.0 111.126 177.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -77.54 -15.56 59.19 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.762 0.825 . . . . 0.0 112.596 175.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -105.92 7.2 41.22 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.919 1.723 . . . . 0.0 112.376 -172.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.91 146.69 27.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.563 1.182 . . . . 0.0 110.054 -172.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 12.7 mtt-85 -111.54 155.45 23.27 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 126.98 2.112 . . . . 0.0 109.427 -173.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.3 m -131.51 23.56 4.74 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 122.145 0.974 . . . . 0.0 110.744 -176.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 . . . . . 0 C--O 1.251 1.16 0 C-N-CA 128.696 2.799 . . . . 0.0 112.243 161.161 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.802 0 N-CA-C 110.36 -1.096 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -86.77 -19.08 29.6 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.992 1.717 . . . . 0.0 112.658 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.6 mmm -67.08 131.9 46.77 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 118.389 0.541 . . . . 0.0 109.611 -176.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.1 tttt 62.42 -171.34 0.16 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.597 1.959 . . . . 0.0 112.489 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -60.9 167.64 2.76 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 166.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.68 ' HG1' ' NE2' ' A' ' 26' ' ' GLN . 32.8 p -135.6 166.97 21.99 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 177.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -57.44 -36.79 71.83 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.844 0.458 . . . . 0.0 110.618 -176.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.68 ' NE2' ' HG1' ' A' ' 24' ' ' THR . 0.0 OUTLIER -62.75 -49.5 74.77 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.92 1.288 . . . . 0.0 110.858 178.091 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -58.56 -39.77 81.2 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.204 1.002 . . . . 0.0 109.69 -175.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 85.9 mt -72.17 -36.49 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 C-N-CA 124.856 1.262 . . . . 0.0 109.809 -176.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -57.01 -33.72 64.53 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 123.653 0.644 . . . . 0.0 112.813 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.06 -55.8 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 118.146 0.973 . . . . 0.0 109.193 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.92 -42.22 75.75 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.98 0.912 . . . . 0.0 111.772 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.45 -51.05 69.88 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.35 1.86 . . . . 0.0 110.799 173.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.52 -25.65 75.3 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 123.264 0.459 . . . . 0.0 112.678 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 74.2 mt -67.49 -20.29 65.44 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 119.575 1.688 . . . . 0.0 112.412 176.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -81.48 -17.39 48.82 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.637 -0.664 . . . . 0.0 112.702 169.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.9 mm -142.95 101.1 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 N-CA-C 106.519 -1.659 . . . . 0.0 106.519 -158.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.2 m 55.8 54.47 9.07 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 123.295 0.638 . . . . 0.0 112.599 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.64 -40.64 44.92 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.121 2.548 . . . . 0.0 111.028 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -65.43 -47.78 75.04 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.774 -0.579 . . . . 0.0 110.29 -170.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -48.23 -45.88 34.75 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.61 1.964 . . . . 0.0 110.396 170.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.16 -46.29 74.47 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -166.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -62.91 -37.73 88.15 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 117.05 -1.452 . . . . 0.0 111.552 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -59.22 -48.43 81.65 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 120.231 1.378 . . . . 0.0 108.989 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -64.9 -40.93 95.86 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 118.433 -0.794 . . . . 0.0 111.001 -172.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.9 mm -63.72 -44.81 98.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 119.284 0.947 . . . . 0.0 110.556 173.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.94 -11.25 26.64 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -116.51 7.6 13.77 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.297 1.439 . . . . 0.0 112.008 174.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 46.12 34.38 2.07 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.295 2.638 . . . . 0.0 112.969 -175.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -82.66 -13.54 56.26 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.7 1.6 . . . . 0.0 113.863 -177.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.6 tp -93.71 123.62 37.17 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.584 -0.698 . . . . 0.0 110.228 -156.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 79.0 t -104.36 140.71 21.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 124.541 1.136 . . . . 0.0 108.176 173.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -108.36 151.35 26.13 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 129.141 2.976 . . . . 0.0 106.841 169.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -165.4 173.9 41.17 Favored Glycine 0 N--CA 1.451 -0.306 0 O-C-N 121.517 -0.74 . . . . 0.0 111.658 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -107.8 143.37 18.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 163.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.2 t -48.5 -60.82 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 125.73 1.612 . . . . 0.0 113.703 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.2 mttt 60.63 165.92 0.09 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.866 1.666 . . . . 0.0 113.262 -170.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -72.7 -7.43 20.78 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.14 1.894 . . . . 0.0 112.514 171.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 m -70.04 -34.85 73.77 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.584 0.754 . . . . 0.0 112.437 -177.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -107.17 167.59 9.8 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 119.005 0.82 . . . . 0.0 112.163 -160.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.9 m -89.17 103.82 16.41 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.071 0.948 . . . . 0.0 109.555 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 28.9 m -140.45 156.58 69.47 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 123.602 0.761 . . . . 0.0 111.899 -164.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -71.84 179.28 4.93 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.649 2.233 . . . . 0.0 110.149 172.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.9 162.76 27.84 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.741 0.816 . . . . 0.0 110.228 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.8 13.56 82.99 Favored Glycine 0 CA--C 1.529 0.918 0 CA-C-O 118.907 -0.941 . . . . 0.0 113.376 171.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.7 m -146.38 75.03 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 C-N-CA 125.685 1.594 . . . . 0.0 108.956 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.53 -15.29 33.28 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 119.964 -1.71 . . . . 0.0 113.183 173.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -150.81 5.72 0.51 Allowed 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 125.528 1.531 . . . . 0.0 110.933 -161.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -69.42 144.33 53.37 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 167.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.5 m -71.01 163.26 27.94 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.309 163.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -142.46 166.95 23.26 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.994 0.918 . . . . 0.0 111.118 169.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 20.4 mt -142.15 134.48 27.83 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 127.338 2.255 . . . . 0.0 107.55 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.6 p -160.95 157.64 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 125.992 1.717 . . . . 0.0 106.648 -171.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.0 157.39 31.22 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.022 -1.049 . . . . 0.0 109.022 167.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.07 -11.35 60.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 118.149 -0.929 . . . . 0.0 112.78 169.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -136.49 21.74 3.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.623 1.569 . . . . 0.0 110.896 -171.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -140.71 43.98 1.83 Allowed 'General case' 0 N--CA 1.471 0.624 0 O-C-N 120.321 -1.487 . . . . 0.0 107.785 172.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.89 -48.33 80.96 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.1 -1.0 . . . . 0.0 110.654 -172.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -76.05 -3.67 37.1 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.48 -98.21 0.8 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.162 0.887 . . . . 0.0 112.166 -173.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 19.4 m -104.79 151.06 24.23 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.487 -1.008 . . . . 0.0 109.405 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.8 tt -153.83 154.41 7.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-N 119.256 0.934 . . . . 0.0 109.339 165.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 53.6 mt -130.25 127.05 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 171.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -102.67 155.79 18.07 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.03 1.332 . . . . 0.0 107.919 168.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 7.0 p90 -161.15 153.89 20.77 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 120.913 -1.117 . . . . 0.0 109.757 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.0 tttt -142.38 119.96 11.76 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 172.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.48 140.66 32.19 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.036 0.835 . . . . 0.0 109.077 169.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -134.72 84.09 2.08 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.212 1.805 . . . . 0.0 108.075 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 73.63 -49.06 1.63 Allowed Glycine 0 CA--C 1.529 0.956 0 C-N-CA 125.969 1.747 . . . . 0.0 113.237 175.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -142.06 -43.51 0.34 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.96 2.104 . . . . 0.0 110.308 166.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 4.4 m -78.75 126.21 30.41 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 120.226 -1.546 . . . . 0.0 109.719 -165.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 23.8 t -105.65 113.39 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.1 mp -83.32 95.19 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 169.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.5 mt -76.55 117.51 21.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 172.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -113.08 83.7 1.87 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.467 1.907 . . . . 0.0 107.865 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -102.3 166.91 10.31 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 120.396 -1.44 . . . . 0.0 110.837 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 13.7 t -136.06 177.88 7.49 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 169.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.8 p -128.31 -3.07 5.6 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 126.228 1.811 . . . . 0.0 110.683 171.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -147.24 142.46 27.24 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 157.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 39.1 mmm-85 -57.74 -34.26 69.33 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.504 0.721 . . . . 0.0 112.834 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.76 13.6 0.62 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -179.049 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.0 p -132.92 158.89 41.47 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 119.482 1.037 . . . . 0.0 110.401 171.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.54 174.24 1.04 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-O 122.253 1.025 . . . . 0.0 110.968 171.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -83.66 149.57 26.43 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.653 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -177.39 0.39 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.224 1.81 . . . . 0.0 108.35 156.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -154.14 94.6 1.75 Allowed 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.006 -1.059 . . . . 0.0 111.558 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.7 tptt -101.43 119.98 39.59 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 173.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -114.44 123.42 49.39 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.922 1.289 . . . . 0.0 109.014 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 24.7 mt -142.84 141.42 31.59 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.322 1.049 . . . . 0.0 109.299 -168.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 p -78.78 148.71 32.85 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 120.411 1.459 . . . . 0.0 111.62 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 9.7 mt -56.44 -30.82 63.32 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 120.855 -1.153 . . . . 0.0 111.937 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -46.92 77.46 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 124.257 1.023 . . . . 0.0 110.981 177.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -55.07 -59.56 4.59 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.575 -1.202 . . . . 0.0 108.99 168.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -48.09 -45.21 32.4 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.423 1.01 . . . . 0.0 111.538 -176.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -69.96 -30.94 68.42 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.47 0.708 . . . . 0.0 111.834 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -65.89 0.63 Allowed 'General case' 0 C--N 1.323 -0.548 0 O-C-N 120.758 -1.214 . . . . 0.0 107.873 169.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -44.54 -51.61 8.75 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.535 2.334 . . . . 0.0 110.311 -172.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -125.18 13.25 8.32 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.132 0.973 . . . . 0.0 111.932 -166.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -136.44 15.52 3.19 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 119.985 1.266 . . . . 0.0 112.375 172.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.545 ' N ' HE21 ' A' ' 123' ' ' GLN 0.261 0.2 OUTLIER -62.11 -45.12 94.87 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 178.725 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.35 -176.11 2.13 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 119.934 1.243 . . . . 0.0 110.579 -164.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -25.02 39.16 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 119.197 -2.189 . . . . 0.0 111.29 170.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.35 -22.13 28.6 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 125.139 1.376 . . . . 0.0 109.563 -166.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.545 HE21 ' N ' ' A' ' 119' ' ' GLN . 2.3 mm-40 -54.94 -33.53 62.35 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.994 0.918 . . . . 0.0 110.644 173.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.84 -3.42 2.43 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.968 1.707 . . . . 0.0 113.109 178.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.06 -2.41 2.56 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 128.35 2.66 . . . . 0.0 111.903 -175.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -112.08 -70.18 0.82 Allowed 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 124.974 1.309 . . . . 0.0 108.174 174.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.6 t -49.33 -58.26 1.43 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 C-N-CA 124.915 1.286 . . . . 0.0 108.901 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -18.46 58.17 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -179.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -85.08 -43.23 14.08 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 125.84 1.656 . . . . 0.0 111.275 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -62.93 -34.49 77.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.25 0.62 . . . . 0.0 110.298 177.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 17.2 t -66.04 -16.73 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.051 -1.031 . . . . 0.0 111.167 173.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -106.58 2.48 26.1 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.408 1.483 . . . . 0.0 111.902 176.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -114.56 -6.68 19.33 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.474 1.035 . . . . 0.0 112.692 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -80.05 169.9 17.2 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.541 1.17 . . . . 0.0 110.229 173.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -124.5 162.56 23.72 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.635 1.974 . . . . 0.0 106.898 175.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.4 m -132.75 11.18 4.36 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.581 0.628 . . . . 0.0 111.807 -175.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 C--O 1.252 1.207 0 C-N-CA 124.208 1.003 . . . . 0.0 108.404 -157.321 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.749 0 CA-C-O 119.895 -0.392 . . . . 0.0 113.024 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -140.29 144.86 36.63 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.577 1.151 . . . . 0.0 108.05 171.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -148.05 176.57 10.09 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 124.583 1.153 . . . . 0.0 110.686 -172.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.6 ptmt -143.26 163.98 31.47 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 126.292 1.837 . . . . 0.0 106.699 173.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 62.25 164.6 0.1 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 128.084 2.554 . . . . 0.0 112.421 -173.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.695 ' HG1' ' NE2' ' A' ' 26' ' ' GLN . 3.1 p -88.13 159.87 18.02 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 173.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -48.54 -47.8 39.01 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.864 0.866 . . . . 0.0 110.488 173.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.695 ' NE2' ' HG1' ' A' ' 24' ' ' THR . 0.1 OUTLIER -54.47 -55.08 32.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.867 0.867 . . . . 0.0 110.374 -179.08 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -58.97 -43.87 91.43 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.734 1.613 . . . . 0.0 110.396 -173.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 85.1 mt -60.89 -45.27 98.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 125.521 1.528 . . . . 0.0 108.592 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -61.74 -35.12 90.76 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 124.206 0.907 . . . . 0.0 112.908 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.4 t -66.23 -51.8 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.107 0 CA-C-N 118.161 0.981 . . . . 0.0 108.634 177.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.35 -40.52 97.51 Favored 'General case' 0 CA--C 1.522 -0.097 0 O-C-N 121.947 -0.471 . . . . 0.0 111.661 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.17 -34.56 76.65 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.469 -0.3 . . . . 0.0 110.576 175.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.22 -28.65 57.8 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.16 -27.08 69.12 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.059 1.429 . . . . 0.0 111.247 170.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.13 -21.67 59.77 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.118 -0.988 . . . . 0.0 111.939 174.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -131.07 91.92 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 125.558 1.543 . . . . 0.0 108.755 -171.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.18 67.5 0.92 Allowed Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.426 1.49 . . . . 0.0 110.041 -178.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -64.25 -33.19 60.72 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.716 2.277 . . . . 0.0 111.528 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -65.16 -48.02 74.99 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 117.56 -1.209 . . . . 0.0 110.32 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -48.7 -61.49 2.01 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.651 0.78 . . . . 0.0 109.912 168.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -45.45 -58.27 3.48 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.137 1.775 . . . . 0.0 109.94 -177.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -63.07 -44.58 95.4 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.787 1.235 . . . . 0.0 111.651 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -62.06 -32.88 73.45 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 119.372 0.987 . . . . 0.0 111.08 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -65.59 -50.34 65.46 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 41.8 mm -60.18 -36.59 69.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 118.518 0.599 . . . . 0.0 111.203 177.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.34 -12.42 21.0 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 118.675 0.67 . . . . 0.0 112.693 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.62 19.8 7.28 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.204 1.802 . . . . 0.0 111.761 172.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 51.71 23.77 2.13 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 127.747 2.419 . . . . 0.0 113.164 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -78.68 -26.45 45.0 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.785 1.234 . . . . 0.0 113.624 -165.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -76.81 145.11 38.67 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.473 1.509 . . . . 0.0 109.69 -157.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 22.0 t -124.31 158.39 31.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 126.453 1.901 . . . . 0.0 108.612 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -124.14 143.11 50.67 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 127.055 2.142 . . . . 0.0 106.571 165.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -149.15 163.97 29.22 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 110.252 -1.139 . . . . 0.0 110.252 169.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 20.1 mm -93.29 144.21 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 105.281 -2.118 . . . . 0.0 105.281 157.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 28.1 t -45.18 -68.13 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 126.454 1.902 . . . . 0.0 112.394 178.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.7 mttt 59.76 150.75 0.09 OUTLIER Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 130.342 3.457 . . . . 0.0 113.178 -165.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -77.74 -16.35 14.72 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.172 1.915 . . . . 0.0 113.335 -170.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -69.25 -3.59 14.4 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.35 -0.844 . . . . 0.0 112.84 175.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -115.55 172.59 7.02 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.574 1.55 . . . . 0.0 108.593 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.9 m -108.9 123.94 49.86 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 -168.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -142.64 155.82 63.36 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.025 0.93 . . . . 0.0 111.374 -170.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -65.93 172.99 7.63 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.563 2.842 . . . . 0.0 111.171 164.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.15 139.81 44.76 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 121.323 -0.861 . . . . 0.0 111.861 -178.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.54 54.45 3.72 Favored Glycine 0 CA--C 1.488 -1.638 0 C-N-CA 126.201 1.858 . . . . 0.0 113.848 172.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.6 p 176.35 71.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 -169.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.9 -16.12 13.93 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.599 1.159 . . . . 0.0 111.27 176.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -145.2 12.71 1.39 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.406 2.282 . . . . 0.0 110.321 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.436 ' CE2' ' HD2' ' A' ' 94' ' ' LYS . 4.1 m-85 -62.21 147.42 47.89 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 168.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.4 m -71.9 159.94 33.4 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 163.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -140.55 155.84 46.48 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.4 1.08 . . . . 0.0 109.982 165.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -117.9 133.76 55.61 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 167.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.6 p -149.83 164.94 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.884 1.674 . . . . 0.0 106.783 169.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -98.31 149.66 22.38 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 119.982 1.264 . . . . 0.0 108.381 171.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.82 -18.69 64.37 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -172.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -136.04 26.43 3.27 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.535 2.334 . . . . 0.0 109.024 -175.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -128.88 39.22 3.83 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 128.138 2.575 . . . . 0.0 105.417 159.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -67.41 -50.3 60.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 127.159 2.184 . . . . 0.0 110.778 -161.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -96.84 39.88 1.16 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.539 1.536 . . . . 0.0 107.664 167.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -116.59 -126.08 3.82 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 126.247 1.879 . . . . 0.0 110.146 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.53 136.18 33.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 117.427 0.614 . . . . 0.0 109.976 -172.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.1 tt -140.19 151.09 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-O 121.585 0.707 . . . . 0.0 109.782 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.8 mt -134.9 108.72 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -77.08 152.98 34.79 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.155 0.889 . . . . 0.0 109.552 167.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.0 p90 -152.86 164.91 36.98 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.313 -1.492 . . . . 0.0 109.825 166.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -148.55 138.04 21.99 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 158.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -74.98 151.24 38.83 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 162.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -138.46 13.54 2.77 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.342 1.857 . . . . 0.0 111.444 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 103.5 100.84 2.61 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 108.79 -1.724 . . . . 0.0 108.79 -178.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 49.6 12.92 0.07 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.576 1.95 . . . . 0.0 115.097 -171.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.68 148.37 39.0 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.892 1.277 . . . . 0.0 107.688 -174.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 60.1 t -135.45 114.72 16.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 125.377 1.471 . . . . 0.0 107.743 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -79.38 101.23 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 167.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mt -79.65 113.11 18.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 169.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.436 ' HD2' ' CE2' ' A' ' 68' ' ' TYR . 13.0 mttt -109.76 100.41 9.42 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -178.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 43.6 p90 -124.7 174.18 8.05 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 121.548 -0.72 . . . . 0.0 110.869 -171.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.5 t -169.42 164.72 10.64 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -173.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -13.38 60.52 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.076 0.95 . . . . 0.0 112.896 166.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -135.56 -170.6 2.64 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.12 0.968 . . . . 0.0 110.754 -162.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.52 -70.38 0.8 Allowed 'General case' 0 CA--C 1.503 -0.839 0 C-N-CA 125.48 1.512 . . . . 0.0 109.798 -173.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -77.23 51.31 0.83 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.644 0.778 . . . . 0.0 112.554 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.1 p -141.81 165.51 27.28 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 119.734 -1.854 . . . . 0.0 111.283 176.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.04 161.55 24.14 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.599 -0.688 . . . . 0.0 110.734 174.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -114.42 160.43 19.18 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.877 1.271 . . . . 0.0 109.966 -163.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -73.96 177.16 5.82 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.511 0.724 . . . . 0.0 109.217 162.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.02 51.4 1.31 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.304 1.041 . . . . 0.0 112.043 -171.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . 0.43 ' HE3' HD23 ' A' ' 108' ' ' LEU . 31.3 tptt -65.56 120.14 12.37 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 106.314 -1.735 . . . . 0.0 106.314 173.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -122.18 93.12 3.89 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 119.883 1.22 . . . . 0.0 108.361 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.43 HD23 ' HE3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -95.92 159.75 14.81 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 123.941 0.896 . . . . 0.0 108.722 178.296 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.616 ' HG1' ' NE2' ' A' ' 112' ' ' GLN . 68.6 p -73.96 155.2 38.89 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.625 167.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 28.3 mt -57.57 -39.12 76.02 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 120.361 -1.462 . . . . 0.0 109.405 166.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 t -63.54 -34.12 77.09 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 124.139 0.976 . . . . 0.0 111.195 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.616 ' NE2' ' HG1' ' A' ' 109' ' ' THR . 0.0 OUTLIER -54.66 -69.18 0.13 Allowed 'General case' 0 C--N 1.345 0.391 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 168.569 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -53.66 -35.26 60.83 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.255 0.622 . . . . 0.0 112.407 -169.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 7.9 tmtm? -62.28 -58.23 8.49 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 118.082 0.401 . . . . 0.0 110.695 173.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.87 -30.48 70.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.703 -170.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.3 -85.36 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.809 2.444 . . . . 0.0 108.023 170.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -90.03 -16.02 30.62 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -161.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -115.06 45.39 1.63 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.146 0.979 . . . . 0.0 110.156 -167.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.421 ' NE2' ' H ' ' A' ' 119' ' ' GLN . 0.0 OUTLIER -81.72 -37.48 27.24 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -164.542 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . 0.314 0.1 OUTLIER -101.17 -164.42 1.11 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.375 1.07 . . . . 0.0 109.968 -173.195 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.92 -22.47 16.3 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.959 1.704 . . . . 0.0 111.971 162.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 35.7 p -80.42 -31.17 37.67 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 117.619 -1.182 . . . . 0.0 110.841 -173.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -61.44 -30.09 70.36 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.397 1.453 . . . . 0.0 110.771 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 12.2 mtpt -52.8 -34.81 55.33 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 118.838 -0.601 . . . . 0.0 109.731 -178.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.47 -26.33 65.16 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.119 -0.943 . . . . 0.0 112.806 -178.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -99.86 -51.61 3.67 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 118.495 0.589 . . . . 0.0 110.065 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.3 t -59.26 -48.44 86.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 O-C-N 121.703 -0.623 . . . . 0.0 110.368 -174.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -61.98 -36.96 83.05 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 121.81 -0.556 . . . . 0.0 111.794 175.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -62.32 -42.8 99.68 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.223 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -58.91 -39.35 81.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.211 1.005 . . . . 0.0 110.306 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 97.8 t -68.95 -33.08 57.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 O-C-N 121.694 -0.629 . . . . 0.0 111.236 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -86.38 -16.28 37.8 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.128 0.877 . . . . 0.0 111.712 174.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.39 -46.29 6.56 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 125.72 1.629 . . . . 0.0 110.787 -178.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.1 pp -55.29 142.44 31.84 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.45 0.643 . . . . 0.0 109.805 176.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.26 171.68 11.73 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.801 1.641 . . . . 0.0 110.103 172.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.76 -5.48 11.57 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.876 0.87 . . . . 0.0 111.782 171.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 . . . . . 0 C--O 1.24 0.567 0 C-N-CA 130.919 3.688 . . . . 0.0 107.098 175.435 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.049 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -138.74 125.93 21.46 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 175.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 44.37 56.7 4.8 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.04 1.736 . . . . 0.0 112.372 -176.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.81 121.07 6.25 Favored 'General case' 0 C--N 1.338 0.097 0 O-C-N 120.933 -1.104 . . . . 0.0 109.733 177.259 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 65.57 -173.56 0.18 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.938 2.495 . . . . 0.0 110.089 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 p -126.53 149.27 49.48 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.251 1.42 . . . . 0.0 107.666 164.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -66.11 -23.89 66.59 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.602 1.161 . . . . 0.0 111.424 -169.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -56.65 -48.88 76.58 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.284 2.233 . . . . 0.0 109.798 170.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -67.72 -36.02 79.84 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.726 1.61 . . . . 0.0 110.742 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 97.6 mt -69.8 -42.84 80.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 C-N-CA 123.975 0.91 . . . . 0.0 111.037 -172.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -65.06 -29.93 76.65 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 119.062 0.847 . . . . 0.0 112.152 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.6 t -62.65 -56.73 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 171.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.4 mp -56.58 -40.36 75.11 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.706 0.802 . . . . 0.0 112.169 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.54 69.69 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.9 0.773 . . . . 0.0 111.069 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.05 -21.88 79.5 Favored Glycine 0 CA--C 1.533 1.168 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 mp -66.06 -22.45 66.42 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 120.268 -1.725 . . . . 0.0 112.116 170.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.85 -18.43 32.88 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.103 -0.951 . . . . 0.0 113.078 173.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -132.71 94.99 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -176.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 59.33 70.52 1.09 Allowed Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 126.698 1.999 . . . . 0.0 111.741 -174.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -56.94 -45.42 36.35 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 122.206 1.937 . . . . 0.0 110.584 173.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.43 -46.21 80.37 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.63 0.772 . . . . 0.0 112.091 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -57.18 -49.33 76.31 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 119.04 0.836 . . . . 0.0 109.559 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.0 tt -55.15 -58.2 8.65 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.8 mtpt -55.48 -39.97 71.09 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.544 1.138 . . . . 0.0 110.97 -174.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -67.6 -48.33 67.11 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 118.317 0.508 . . . . 0.0 111.019 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -66.26 -29.24 69.44 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.818 -176.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.4 mm -64.61 -45.39 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 119.706 1.139 . . . . 0.0 109.764 169.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.83 -10.06 34.53 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.972 -1.08 . . . . 0.0 112.759 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.86 -4.7 25.83 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.334 1.453 . . . . 0.0 112.991 171.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 46.1 39.8 6.36 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.329 1.452 . . . . 0.0 110.496 -167.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.68 -13.44 15.57 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.303 1.441 . . . . 0.0 112.373 -177.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.8 134.52 34.31 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.036 0.934 . . . . 0.0 108.93 -167.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.6 t -117.23 164.79 13.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 125.704 1.602 . . . . 0.0 109.232 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -144.21 110.56 5.51 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 129.698 3.199 . . . . 0.0 103.214 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.51 170.8 24.6 Favored Glycine 0 CA--C 1.518 0.253 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 170.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 42.2 mm -99.96 143.53 13.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -175.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.9 t -51.18 -60.43 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 C-N-CA 124.98 1.312 . . . . 0.0 111.538 174.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.5 mttt 60.14 165.69 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 125.361 1.464 . . . . 0.0 113.909 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -63.92 -25.83 67.02 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.865 1.71 . . . . 0.0 112.743 170.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 30.4 m -86.75 2.7 47.85 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -164.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -125.14 160.78 28.33 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 119.69 1.132 . . . . 0.0 110.548 -170.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.0 m -89.3 114.89 26.33 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.655 0.782 . . . . 0.0 109.101 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 6.0 m -143.04 165.24 27.16 Favored Pre-proline 0 C--O 1.237 0.436 0 O-C-N 121.369 -0.832 . . . . 0.0 112.428 -170.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -66.89 165.0 27.49 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.136 2.557 . . . . 0.0 111.495 168.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.49 137.92 54.81 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 121.835 -0.54 . . . . 0.0 110.562 174.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.0 25.22 11.55 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-O 118.756 -1.024 . . . . 0.0 114.783 161.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.6 m -136.54 29.58 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 124.515 1.126 . . . . 0.0 110.883 -174.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -58.16 -16.27 12.83 Favored 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 117.584 2.439 . . . . 0.0 117.584 -153.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -156.2 32.56 0.33 Allowed 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 127.465 2.306 . . . . 0.0 108.985 172.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -69.4 155.91 39.68 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 167.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.67 153.8 36.94 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 161.058 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -136.81 149.49 47.78 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.724 0.809 . . . . 0.0 109.828 164.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.91 127.17 54.78 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 175.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -145.56 159.6 12.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 171.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.84 159.43 19.71 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 169.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.86 -18.78 57.98 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -122.95 7.69 9.29 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.75 1.62 . . . . 0.0 112.539 -173.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -110.38 21.18 16.98 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.0 0.92 . . . . 0.0 111.16 -174.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -49.08 -44.32 41.88 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 128.054 2.542 . . . . 0.0 113.096 -167.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -103.57 -8.81 19.75 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.967 0.907 . . . . 0.0 111.948 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.3 -69.36 1.4 Allowed Glycine 0 C--N 1.334 0.467 0 C-N-CA 125.73 1.633 . . . . 0.0 110.36 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.59 161.83 36.96 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.895 0.847 . . . . 0.0 110.815 -170.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tt -163.18 152.23 3.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 171.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.7 mt -133.36 143.67 38.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 168.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -118.5 149.91 40.5 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.826 1.651 . . . . 0.0 108.194 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -147.35 159.99 43.04 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.047 1.294 . . . . 0.0 111.87 171.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.0 tttm -154.85 110.59 3.14 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.173 0.589 . . . . 0.0 110.692 167.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.42 108.73 2.06 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 127.992 2.517 . . . . 0.0 112.87 172.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -121.45 97.58 5.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.726 1.21 . . . . 0.0 111.345 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 48.92 77.43 0.12 Allowed Glycine 0 CA--C 1.522 0.509 0 C-N-CA 124.317 0.961 . . . . 0.0 113.199 174.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 68.43 -86.56 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.503 1.921 . . . . 0.0 107.906 -155.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.2 m -64.11 131.63 48.08 Favored 'General case' 0 C--N 1.314 -0.962 0 C-N-CA 125.043 1.337 . . . . 0.0 113.769 -157.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 2.8 m -101.05 114.6 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 O-C-N 121.089 -1.007 . . . . 0.0 111.424 -179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.3 mp -72.6 100.59 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 172.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 16.8 mt -81.08 139.76 17.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 167.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -129.7 112.53 13.74 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.273 1.429 . . . . 0.0 107.484 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.3 p90 -137.55 167.43 21.68 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 120.854 -1.154 . . . . 0.0 110.533 -168.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -153.48 170.86 19.71 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.681 0.753 . . . . 0.0 109.258 -173.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.88 0.6 13.8 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.257 1.023 . . . . 0.0 110.827 169.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -143.87 153.45 42.35 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 124.108 0.963 . . . . 0.0 111.557 168.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -77.78 1.96 18.58 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 121.421 -0.8 . . . . 0.0 112.409 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.58 1.45 14.27 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.038 1.495 . . . . 0.0 115.038 -174.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.6 p -120.04 173.09 7.29 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.722 0.809 . . . . 0.0 112.544 -165.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.7 tptt -71.26 132.1 44.45 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.597 0.759 . . . . 0.0 109.924 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -64.18 132.29 49.96 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.243 0.544 . . . . 0.0 109.562 170.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -67.1 175.43 2.59 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 125.358 1.463 . . . . 0.0 109.425 164.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -124.48 153.07 42.56 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.895 1.278 . . . . 0.0 110.007 176.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -165.3 109.63 0.87 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 127.567 2.347 . . . . 0.0 104.773 168.021 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.05 121.5 39.01 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 115.412 -2.232 . . . . 0.0 108.073 -171.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -119.64 121.97 40.48 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 122.869 2.577 . . . . 0.0 110.782 -171.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.9 p -59.17 143.97 47.3 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.299 0.571 . . . . 0.0 109.946 176.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 29.3 mt -52.31 -31.58 33.69 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.612 -1.305 . . . . 0.0 112.166 171.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.1 t -64.05 -43.36 95.72 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 117.169 -1.396 . . . . 0.0 111.819 174.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -51.88 -65.58 0.53 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-N 119.57 1.077 . . . . 0.0 109.512 173.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -56.9 -34.23 67.7 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.354 0.525 . . . . 0.0 111.647 -169.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 ttmp? -70.71 -40.16 73.0 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 118.689 -0.672 . . . . 0.0 110.53 -177.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -59.15 3.95 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 173.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -47.46 -50.81 22.09 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 124.184 0.928 . . . . 0.0 111.978 -173.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -130.55 14.65 5.47 Favored 'General case' 0 C--O 1.226 -0.182 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -165.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -149.69 22.83 0.9 Allowed 'General case' 0 C--O 1.239 0.54 0 O-C-N 120.521 -1.362 . . . . 0.0 113.157 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.51 -29.04 58.13 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.094 1.758 . . . . 0.0 113.846 -176.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 9.6 t -135.7 159.9 40.19 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.069 1.348 . . . . 0.0 111.052 -169.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -71.08 -33.02 69.81 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.867 176.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.57 -37.83 88.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 119.686 1.13 . . . . 0.0 109.918 -176.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -63.27 -19.27 64.42 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.661 1.185 . . . . 0.0 112.955 175.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -55.72 -32.91 63.76 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 117.836 -1.078 . . . . 0.0 111.298 174.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -54.21 -59.19 5.0 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 124.039 0.837 . . . . 0.0 110.469 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.07 -47.04 39.29 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 123.35 0.66 . . . . 0.0 110.455 -168.211 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 58.1 t -56.4 -56.53 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -59.35 -31.09 68.88 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 118.529 -0.748 . . . . 0.0 113.014 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -67.68 -37.57 82.51 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 119.064 0.847 . . . . 0.0 111.187 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -61.64 -42.46 98.93 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.611 0.641 . . . . 0.0 109.595 171.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 15.4 t -63.1 -38.89 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 121.445 -0.784 . . . . 0.0 110.517 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -81.14 -18.87 44.9 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.824 0.85 . . . . 0.0 112.535 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -108.27 -5.59 32.31 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 125.531 1.539 . . . . 0.0 114.103 -177.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.6 pp -78.08 146.09 35.42 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 118.764 1.282 . . . . 0.0 108.953 170.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 2.7 mtp-105 -90.38 165.01 14.1 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 124.149 0.98 . . . . 0.0 108.978 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.0 m -121.69 6.07 9.99 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.696 0.798 . . . . 0.0 111.203 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . 0.331 7.8 pt-20 . . . . . 0 C--O 1.247 0.921 0 C-N-CA 129.47 3.108 . . . . 0.0 113.177 -162.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.974 0 N-CA-C 111.89 -0.484 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -159.58 43.35 0.22 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.553 1.541 . . . . 0.0 109.376 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.7 tpt -147.98 134.52 19.77 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 120.855 -1.153 . . . . 0.0 107.894 173.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . 0.259 0.0 OUTLIER 53.1 -179.39 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.639 2.376 . . . . 0.0 113.667 -174.404 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -59.65 123.74 17.88 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 168.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.615 ' HG1' ' NE2' ' A' ' 26' ' ' GLN . 10.3 p -93.57 165.58 12.67 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -56.36 -44.26 79.96 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.968 0.804 . . . . 0.0 110.211 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.615 ' NE2' ' HG1' ' A' ' 24' ' ' THR . 0.0 OUTLIER -57.36 -50.64 72.32 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.57 0.748 . . . . 0.0 110.03 179.536 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -59.01 -48.38 81.8 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.564 1.145 . . . . 0.0 109.708 -175.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.2 mt -65.5 -35.91 76.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -175.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -57.83 -36.6 80.62 Favored Glycine 0 C--N 1.338 0.654 0 CA-C-O 118.967 -0.907 . . . . 0.0 112.712 177.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 75.6 t -70.13 -46.45 72.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 118.176 0.988 . . . . 0.0 109.157 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.1 mp -60.15 -46.31 90.09 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.398 1.079 . . . . 0.0 111.508 177.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.99 -48.66 64.31 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.676 1.19 . . . . 0.0 110.515 175.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.07 -30.36 77.53 Favored Glycine 0 C--N 1.337 0.623 0 CA-C-O 119.15 -0.806 . . . . 0.0 113.619 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 68.3 mt -63.77 -22.59 66.98 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 119.698 1.749 . . . . 0.0 112.408 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -94.56 -16.39 23.3 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 118.526 -0.75 . . . . 0.0 112.272 174.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -126.59 94.64 2.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.0 65.88 2.22 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 125.417 1.487 . . . . 0.0 111.865 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.38 -44.17 48.65 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.067 2.511 . . . . 0.0 111.891 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -66.9 -38.74 86.81 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.971 0.908 . . . . 0.0 110.251 -173.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 75.7 t90 -55.66 -56.31 21.94 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.7 tt -54.86 -52.3 63.22 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.867 -0.52 . . . . 0.0 110.785 -178.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.7 mttm -56.24 -47.7 77.96 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.655 0.782 . . . . 0.0 111.65 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -66.07 -38.48 88.4 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 118.937 0.79 . . . . 0.0 110.15 -177.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -69.12 -42.04 76.58 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.648 0.658 . . . . 0.0 110.62 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 25.4 mm -57.62 -40.29 74.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 119.203 0.911 . . . . 0.0 110.645 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.86 -20.08 55.02 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -119.96 23.25 11.13 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 120.949 -1.095 . . . . 0.0 112.117 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.4 t30 45.18 35.41 1.7 Allowed 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.967 2.107 . . . . 0.0 110.748 -176.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -79.52 -12.66 59.86 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 121.28 -0.887 . . . . 0.0 109.799 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -107.77 123.55 48.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 119.144 0.884 . . . . 0.0 108.863 -156.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.5 p -111.11 142.98 21.9 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 C-N-CA 124.565 1.146 . . . . 0.0 109.427 -178.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -99.0 137.78 37.04 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 126.065 1.746 . . . . 0.0 106.703 163.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.06 178.64 30.83 Favored Glycine 0 CA--C 1.522 0.494 0 CA-C-N 119.349 0.977 . . . . 0.0 110.944 176.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 18.4 mm -115.07 146.59 19.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 125.557 1.543 . . . . 0.0 107.371 172.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 32.2 t -54.11 -75.49 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.253 1.273 0 C-N-CA 126.067 1.747 . . . . 0.0 110.935 171.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp 54.33 158.23 0.06 OUTLIER Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 129.291 3.036 . . . . 0.0 112.06 -156.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -70.87 -4.9 15.7 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 122.334 2.023 . . . . 0.0 111.526 167.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.4 m -67.98 3.55 1.52 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.53 1.932 . . . . 0.0 113.409 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -136.32 173.55 11.59 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.271 1.396 . . . . 0.0 110.668 -173.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 m -90.11 104.12 16.73 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.255 1.822 . . . . 0.0 108.118 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.0 m -150.44 154.39 35.66 Favored Pre-proline 0 C--O 1.238 0.488 0 O-C-N 121.894 -0.504 . . . . 0.0 111.625 -168.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.21 166.42 26.96 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.684 2.256 . . . . 0.0 110.954 175.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -76.79 146.93 37.55 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.477 0.711 . . . . 0.0 110.482 -174.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.01 32.53 44.16 Favored Glycine 0 CA--C 1.528 0.858 0 O-C-N 121.693 -0.629 . . . . 0.0 113.976 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.9 m -133.63 26.12 1.15 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-N 118.787 1.294 . . . . 0.0 109.806 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -61.05 -16.16 40.54 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -154.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -143.81 14.88 1.74 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 127.337 2.255 . . . . 0.0 111.516 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -66.27 146.29 54.78 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.52 161.98 29.76 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.159 163.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 21.4 p90 -135.55 172.25 13.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 125.23 1.412 . . . . 0.0 109.604 165.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.9 mt -130.91 135.84 48.04 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 106.181 -1.785 . . . . 0.0 106.181 168.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.7 p -149.19 152.64 11.82 Favored 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-N 120.431 1.469 . . . . 0.0 110.766 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.86 112.39 15.98 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 172.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.16 -9.66 18.14 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 129.565 3.146 . . . . 0.0 114.735 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -106.55 -39.33 5.89 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.478 0.711 . . . . 0.0 109.733 169.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -94.55 51.01 1.38 Allowed 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 -171.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -67.82 -2.67 7.63 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -166.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -124.45 14.35 8.86 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.194 1.798 . . . . 0.0 111.459 166.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -80.23 -88.09 0.55 Allowed Glycine 0 N--CA 1.448 -0.531 0 O-C-N 120.835 -1.165 . . . . 0.0 111.194 175.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.3 m -130.69 160.86 33.04 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 123.799 0.84 . . . . 0.0 109.291 -170.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.8 tt -154.25 153.79 7.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 169.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 8.7 mt -139.73 112.21 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 119.017 0.826 . . . . 0.0 109.503 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -86.34 154.7 21.02 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.22 0.918 . . . . 0.0 110.987 177.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.7 p90 -163.06 155.59 18.66 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.995 0.918 . . . . 0.0 109.682 172.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.7 tttt -143.25 113.45 7.27 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 123.976 0.91 . . . . 0.0 108.568 167.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -84.81 95.91 9.13 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -66.01 -2.69 4.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.371 0.669 . . . . 0.0 112.385 179.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 91.62 127.64 4.01 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 107.45 -2.26 . . . . 0.0 107.45 -178.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 90.8 mm-40 52.9 -12.82 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.473 1.909 . . . . 0.0 115.364 -162.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 59.9 m -144.37 156.81 44.4 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 122.346 2.339 . . . . 0.0 109.604 175.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 6.9 p -146.89 106.95 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 C-N-CA 124.892 1.277 . . . . 0.0 111.442 -175.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -78.47 108.27 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 176.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 27.0 mt -95.49 126.01 48.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 125.339 1.456 . . . . 0.0 108.258 174.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -123.81 101.73 7.43 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 126.071 1.749 . . . . 0.0 106.709 -173.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 27.6 p90 -116.96 166.49 12.12 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.161 -0.962 . . . . 0.0 111.746 -176.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -147.88 169.08 20.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.094 1.358 . . . . 0.0 109.339 173.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.7 p -108.98 -2.67 18.08 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.046 2.539 . . . . 0.0 111.171 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -135.38 131.8 36.78 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 124.407 1.083 . . . . 0.0 108.871 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -23.89 40.48 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -97.78 -0.03 46.03 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 116.354 1.983 . . . . 0.0 116.354 -167.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.7 p -116.48 167.16 11.3 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -165.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -72.5 152.96 41.6 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.486 -0.759 . . . . 0.0 109.408 176.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -87.9 162.75 16.74 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.77 0.828 . . . . 0.0 111.567 -167.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -73.44 -173.85 1.51 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.882 1.673 . . . . 0.0 108.989 166.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.0 93.91 2.56 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.081 0.952 . . . . 0.0 111.053 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.9 tptt -103.2 150.3 23.82 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 163.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -140.88 125.82 18.23 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 115.708 -2.091 . . . . 0.0 107.159 175.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -121.8 158.63 28.44 Favored 'General case' 0 CA--C 1.499 -1.015 0 CA-C-N 122.114 2.233 . . . . 0.0 108.316 -177.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.422 ' HG1' ' NE2' ' A' ' 112' ' ' GLN . 68.7 p -74.08 156.56 37.31 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 119.891 1.223 . . . . 0.0 109.365 166.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 34.5 mt -59.33 -36.1 75.06 Favored 'General case' 0 C--N 1.34 0.154 0 O-C-N 121.441 -0.787 . . . . 0.0 110.079 167.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.86 -36.44 82.32 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.799 -177.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . 0.422 ' NE2' ' HG1' ' A' ' 109' ' ' THR . 0.0 OUTLIER -51.31 -59.05 4.64 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 124.062 0.945 . . . . 0.0 109.137 171.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -56.14 -40.03 73.17 Favored 'General case' 0 C--N 1.339 0.125 0 C-N-CA 123.09 0.556 . . . . 0.0 112.071 -175.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -63.58 -45.35 90.81 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 121.784 -0.573 . . . . 0.0 110.009 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -35.06 74.45 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.242 -0.409 . . . . 0.0 110.436 -177.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.46 -58.84 4.03 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.373 0.669 . . . . 0.0 109.241 177.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -134.26 19.17 3.7 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -161.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -141.01 66.34 1.37 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.268 1.395 . . . . 0.0 112.867 171.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -119.32 -25.54 6.07 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 -167.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.2 t -139.66 152.59 46.86 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 120.423 1.465 . . . . 0.0 108.644 -172.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -58.85 -30.51 67.76 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 119.916 -1.74 . . . . 0.0 113.202 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 65.5 m -53.05 -48.3 67.77 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 118.637 -0.697 . . . . 0.0 110.388 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.38 -33.03 64.81 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 117.169 -1.812 . . . . 0.0 107.88 -178.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 35.2 mtpt -62.94 -3.39 1.6 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 114.22 1.193 . . . . 0.0 114.22 174.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -76.55 -81.89 0.08 Allowed 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 105.35 -2.093 . . . . 0.0 105.35 155.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.64 -49.57 76.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -163.193 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . 0.474 ' HA ' ' CD2' ' A' ' 130' ' ' TYR . 38.3 t -56.86 -38.24 58.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 125.346 1.458 . . . . 0.0 110.722 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.62 -32.88 47.66 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.396 -0.815 . . . . 0.0 110.871 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -69.15 -31.38 70.0 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 120.899 -1.125 . . . . 0.0 111.461 175.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.474 ' CD2' ' HA ' ' A' ' 127' ' ' VAL . 14.7 m-85 -63.06 -24.68 68.02 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 120.496 -1.378 . . . . 0.0 111.237 172.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 40.3 t -78.19 -11.99 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 122.942 0.497 . . . . 0.0 110.445 174.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -104.71 -17.01 14.79 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.423 1.089 . . . . 0.0 111.972 172.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -96.91 17.94 58.39 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 125.762 1.648 . . . . 0.0 113.026 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.0 pp -106.45 149.08 27.41 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 122.18 0.99 . . . . 0.0 110.275 177.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.1 mtt-85 -75.61 169.33 18.32 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.185 2.194 . . . . 0.0 107.83 163.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.22 -3.84 2.42 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.328 1.051 . . . . 0.0 113.014 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 C--O 1.245 0.847 0 C-N-CA 131.162 3.785 . . . . 0.0 107.145 177.196 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.602 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 10.4 m80 -77.16 156.02 31.88 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.562 1.181 . . . . 0.0 110.265 174.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 14.2 ptt? -120.46 170.07 9.73 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.908 1.683 . . . . 0.0 110.042 174.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -137.08 140.52 42.04 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 125.079 1.352 . . . . 0.0 108.286 175.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 49.14 -173.05 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.937 1.695 . . . . 0.0 112.126 -165.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -141.2 144.68 34.9 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 129.223 3.009 . . . . 0.0 106.438 174.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -53.01 -43.57 66.6 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 120.174 1.352 . . . . 0.0 110.531 -174.089 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.13 -54.22 7.09 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.065 1.746 . . . . 0.0 110.942 174.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.8 mm-40 -68.35 -36.9 79.93 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.675 1.19 . . . . 0.0 111.496 -177.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 97.9 mt -71.8 -39.92 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.066 0 C-N-CA 123.632 0.773 . . . . 0.0 109.39 -173.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.13 -35.55 92.13 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-N 118.828 0.74 . . . . 0.0 112.199 -175.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.6 -45.33 98.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 118.303 1.051 . . . . 0.0 109.534 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.62 -38.47 90.35 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.981 0.912 . . . . 0.0 110.711 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.95 -41.03 83.11 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.707 0.803 . . . . 0.0 111.188 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.71 -33.44 71.35 Favored Glycine 0 CA--C 1.528 0.87 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 176.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.57 -30.25 71.39 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 120.639 -1.507 . . . . 0.0 111.38 172.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.31 64.43 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 117.683 -1.151 . . . . 0.0 112.189 172.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -135.56 96.71 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 C-N-CA 125.375 1.47 . . . . 0.0 107.885 -165.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 60.98 67.41 1.46 Allowed Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.524 1.13 . . . . 0.0 109.762 -177.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -60.29 -33.88 94.18 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.734 2.289 . . . . 0.0 110.866 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -70.37 -39.64 74.48 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.66 -0.65 . . . . 0.0 111.955 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.1 t90 -56.97 -53.23 60.42 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.131 0.878 . . . . 0.0 108.859 174.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -46.4 -57.14 4.93 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.437 1.495 . . . . 0.0 109.329 173.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.1 mtpt -61.68 -41.08 97.08 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.464 1.106 . . . . 0.0 112.27 -175.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -67.55 -48.09 67.97 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.46 1.027 . . . . 0.0 109.562 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -42.03 81.05 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.801 0.441 . . . . 0.0 110.2 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.2 mm -60.52 -54.9 28.74 Favored 'Isoleucine or valine' 0 C--N 1.341 0.236 0 C-N-CA 124.438 1.095 . . . . 0.0 110.132 174.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.75 -42.85 65.33 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.352 0.661 . . . . 0.0 110.691 -175.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.23 -8.44 53.61 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 50.34 40.66 23.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.946 1.698 . . . . 0.0 110.979 -165.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -111.64 -5.57 14.48 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.871 0.868 . . . . 0.0 113.337 178.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.0 tp -73.63 128.7 36.21 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 119.172 0.896 . . . . 0.0 109.643 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.8 t -113.54 150.18 15.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 169.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -120.02 149.18 42.58 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 128.067 2.547 . . . . 0.0 106.908 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -163.7 177.21 39.64 Favored Glycine 0 N--CA 1.45 -0.413 0 N-CA-C 111.581 -0.607 . . . . 0.0 111.581 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.6 mm -106.45 149.24 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 125.375 1.47 . . . . 0.0 107.055 168.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.7 t -52.4 -86.02 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-O 116.866 -1.54 . . . . 0.0 110.627 172.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 55.3 mmtt 55.44 164.99 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.925 0 CA-C-N 120.408 1.458 . . . . 0.0 112.956 -167.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -84.12 -3.36 10.29 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.36 2.707 . . . . 0.0 114.632 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.5 m -59.36 -24.16 63.16 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.369 1.068 . . . . 0.0 113.409 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.16 165.75 17.68 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 128.982 2.913 . . . . 0.0 108.103 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.4 t -65.64 146.69 54.5 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 121.781 -0.574 . . . . 0.0 109.568 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 1.9 m -153.55 162.36 26.82 Favored Pre-proline 0 C--O 1.237 0.413 0 C-N-CA 125.73 1.612 . . . . 0.0 108.865 174.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -75.71 167.82 25.59 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.798 2.332 . . . . 0.0 110.423 171.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.68 139.81 51.32 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 123.62 0.768 . . . . 0.0 109.996 171.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.54 39.45 5.01 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 125.797 1.665 . . . . 0.0 112.842 169.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.3 m -152.2 27.79 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 125.454 1.501 . . . . 0.0 111.143 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -65.75 -16.19 63.54 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -151.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -153.07 52.06 0.74 Allowed 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 128.547 2.739 . . . . 0.0 106.542 169.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -89.46 154.89 19.68 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 164.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.63 162.14 28.51 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 164.201 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -141.3 170.76 15.12 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.539 1.136 . . . . 0.0 109.757 166.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 18.7 mt -141.22 138.66 33.46 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 126.461 1.904 . . . . 0.0 107.176 174.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 10.8 p -162.4 155.82 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 125.636 1.574 . . . . 0.0 107.571 177.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.04 158.18 30.7 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 119.724 1.147 . . . . 0.0 108.97 170.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.26 -21.23 66.11 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 177.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' A' ' 77' ' ' GLN . 24.7 m-20 -100.01 -32.01 11.17 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.11 0.964 . . . . 0.0 111.305 176.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.08 13.84 0.19 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.551 2.341 . . . . 0.0 112.076 -178.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . 0.439 ' NE2' HH22 ' A' ' 99' ' ' ARG . 17.9 mm100 -59.5 -12.33 6.13 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.95 1.7 . . . . 0.0 113.793 -171.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.59 -2.83 9.36 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.923 0.889 . . . . 0.0 112.119 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.02 -87.92 1.72 Allowed Glycine 0 CA--C 1.526 0.764 0 C-N-CA 124.405 1.002 . . . . 0.0 112.483 -174.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 m -103.62 166.96 10.1 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.709 1.204 . . . . 0.0 109.298 -174.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.3 tt -166.65 151.24 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 124.64 1.176 . . . . 0.0 107.983 165.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.9 mt -134.6 99.19 2.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -78.6 153.04 31.46 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -157.9 158.96 36.04 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.491 -0.755 . . . . 0.0 109.333 167.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.02 106.89 4.66 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 167.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -82.69 147.61 28.39 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 168.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -147.57 -153.74 0.51 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 126.127 1.771 . . . . 0.0 107.911 -167.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.93 88.89 0.01 OUTLIER Glycine 0 CA--C 1.527 0.795 0 C-N-CA 125.815 1.674 . . . . 0.0 111.432 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 53.88 8.72 0.17 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.554 2.342 . . . . 0.0 115.491 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.6 m -125.35 163.48 22.49 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.554 1.942 . . . . 0.0 108.124 -175.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 7.7 p -151.19 106.37 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -0.99 0 C-N-CA 125.158 1.383 . . . . 0.0 111.865 174.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -74.41 96.65 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 172.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 15.3 mt -77.8 127.56 38.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 105.991 -1.855 . . . . 0.0 105.991 163.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -127.11 97.14 4.83 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 125.389 1.475 . . . . 0.0 107.343 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 47.7 p90 -124.03 167.6 13.97 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.018 -1.051 . . . . 0.0 109.69 -173.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . 0.3 9.8 t -131.68 -163.71 1.36 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.83 0.824 . . . . 0.0 109.557 -166.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 p -122.59 -1.63 9.0 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 120.874 -1.141 . . . . 0.0 111.209 152.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -153.48 145.44 23.62 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 124.606 1.163 . . . . 0.0 111.697 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.439 HH22 ' NE2' ' A' ' 77' ' ' GLN . 11.1 mmt180 -52.13 -33.75 41.35 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 167.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -79.71 -5.22 54.79 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 -173.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -133.11 163.93 28.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -168.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.491 ' HD2' ' H ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -69.45 164.02 24.0 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.553 1.168 . . . . 0.0 111.452 -164.866 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.491 ' H ' ' HD2' ' A' ' 102' ' ' LYS . 1.3 mm? -94.9 138.3 32.83 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.99 -1.005 . . . . 0.0 108.707 -174.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 7.8 mptt -60.38 169.18 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.627 1.171 . . . . 0.0 109.86 161.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -127.07 90.62 3.18 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.765 1.226 . . . . 0.0 109.849 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.71 83.66 1.88 Allowed 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 171.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.43 138.65 47.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 117.241 -1.361 . . . . 0.0 107.334 168.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.0 mt -133.79 -177.45 4.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 120.693 1.588 . . . . 0.0 106.795 171.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 62.1 p -101.13 155.73 17.83 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.666 0.746 . . . . 0.0 110.467 172.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 21.7 mt -59.83 -16.67 30.32 Favored 'General case' 0 C--O 1.237 0.435 0 O-C-N 121.641 -0.662 . . . . 0.0 112.238 166.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.16 -50.95 10.18 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 117.561 -1.209 . . . . 0.0 109.5 172.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -44.95 -61.27 1.68 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 124.403 1.081 . . . . 0.0 109.517 176.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.4 -36.93 74.31 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.214 0.916 . . . . 0.0 112.052 -168.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -65.2 -45.01 86.54 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.522 -0.736 . . . . 0.0 110.417 173.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.27 -2.01 26.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.868 2.067 . . . . 0.0 113.505 177.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -105.95 -46.57 4.07 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.067 1.747 . . . . 0.0 109.69 179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -139.16 16.9 2.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.373 1.069 . . . . 0.0 113.248 -166.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -139.68 14.86 2.52 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 120.862 -1.149 . . . . 0.0 113.331 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.573 ' NE2' HE22 ' A' ' 123' ' ' GLN . 2.2 pm0 -58.2 -64.15 1.02 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 9.6 p -73.37 179.56 3.92 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.914 0.779 . . . . 0.0 111.286 -168.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 36.2 mtt85 -81.51 -55.85 4.41 Favored 'General case' 0 CA--C 1.507 -0.696 0 O-C-N 121.46 -0.775 . . . . 0.0 111.642 170.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 11.5 m -66.13 -26.99 67.7 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.191 -168.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.573 HE22 ' NE2' ' A' ' 119' ' ' GLN . 12.9 tt0 -55.64 -37.77 68.64 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.159 0.584 . . . . 0.0 111.015 173.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.4 mtpt -62.2 -28.43 69.67 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 118.157 -0.925 . . . . 0.0 110.71 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -63.86 -51.76 63.15 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.89 -57.31 9.15 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 123.6 0.76 . . . . 0.0 110.978 178.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 65.9 t -51.23 -51.14 24.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -73.78 -24.83 59.89 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.8 0.727 . . . . 0.0 112.555 -176.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -61.04 -48.02 83.67 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.926 0.89 . . . . 0.0 109.274 166.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 7.7 m-30 -61.28 -41.02 96.25 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.875 0.87 . . . . 0.0 109.719 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.0 t -64.17 -22.56 31.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 O-C-N 121.14 -0.975 . . . . 0.0 110.837 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -104.08 -13.94 16.09 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 119.842 1.201 . . . . 0.0 113.075 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.98 -27.17 58.85 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 124.459 1.028 . . . . 0.0 110.686 174.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.5 pp -73.42 147.29 44.37 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 118.3 1.05 . . . . 0.0 110.282 175.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -105.83 167.03 10.06 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.474 1.51 . . . . 0.0 107.785 -177.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.7 m -126.34 3.06 7.02 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.438 1.017 . . . . 0.0 111.431 175.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.149 0 C-N-CA 127.509 2.324 . . . . 0.0 107.181 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.657 0 CA-C-O 119.073 -0.848 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -63.37 98.31 0.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.594 1.558 . . . . 0.0 111.725 -169.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 25.2 ttt -155.68 138.19 15.0 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 120.318 1.417 . . . . 0.0 110.496 174.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? 74.75 101.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 129.209 3.004 . . . . 0.0 108.826 -167.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 56.35 -174.92 0.06 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.765 1.226 . . . . 0.0 109.995 -178.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.0 p -141.52 153.49 44.92 Favored 'General case' 0 N--CA 1.463 0.209 0 O-C-N 120.46 -1.4 . . . . 0.0 111.245 -177.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -61.21 -39.0 88.58 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.494 0.717 . . . . 0.0 110.846 -167.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -49.88 70.68 Favored 'General case' 0 C--N 1.341 0.196 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -177.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 60.9 mm-40 -60.81 -47.44 86.35 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.998 1.319 . . . . 0.0 109.29 -177.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 84.5 mt -61.34 -38.5 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 123.433 0.693 . . . . 0.0 110.242 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.64 -19.67 73.26 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 119.136 -0.813 . . . . 0.0 113.636 -178.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.9 t -70.53 -52.66 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 170.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.83 -36.29 83.44 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 122.297 -0.252 . . . . 0.0 110.755 -176.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.63 -49.67 69.98 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.424 0.69 . . . . 0.0 111.622 171.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.93 -34.3 88.14 Favored Glycine 0 CA--C 1.529 0.935 0 CA-C-O 119.56 -0.578 . . . . 0.0 111.726 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.19 -27.51 68.74 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.412 1.606 . . . . 0.0 112.041 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.36 -14.56 60.08 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.089 -1.007 . . . . 0.0 112.653 172.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 45.2 mm -136.43 89.65 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 124.947 1.299 . . . . 0.0 107.583 -167.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.65 60.49 1.42 Allowed Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.652 1.181 . . . . 0.0 110.376 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -58.28 -33.86 98.07 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.286 2.658 . . . . 0.0 112.511 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.61 -34.71 78.9 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.083 0.553 . . . . 0.0 111.762 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -64.94 -55.92 16.3 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 175.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.2 tt -49.15 -50.3 38.29 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.903 0.481 . . . . 0.0 110.055 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -55.56 -54.23 46.58 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.439 1.096 . . . . 0.0 112.041 177.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -56.82 -42.18 79.14 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.675 0.671 . . . . 0.0 111.689 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -65.02 -53.04 52.3 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.334 1.053 . . . . 0.0 109.992 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 mm -58.61 -40.88 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 C-N-CA 124.555 1.142 . . . . 0.0 109.78 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.17 -8.44 17.12 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.648 0.779 . . . . 0.0 112.802 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -121.36 5.86 10.18 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.013 1.725 . . . . 0.0 111.87 175.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 44.95 33.16 0.95 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.516 1.927 . . . . 0.0 111.825 -168.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -98.96 43.48 1.06 Allowed 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 176.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -134.52 142.46 47.02 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.572 1.078 . . . . 0.0 108.284 172.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.8 p -126.53 165.84 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 C-N-CA 126.651 1.98 . . . . 0.0 110.579 175.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -131.62 120.19 22.49 Favored 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 103.232 -2.877 . . . . 0.0 103.232 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -135.46 -178.98 16.11 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mm -122.39 144.54 31.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 C-N-CA 125.631 1.572 . . . . 0.0 107.545 172.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.7 t -45.85 -75.19 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 C-N-CA 128.481 2.713 . . . . 0.0 111.958 174.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 19.4 mmtp 57.3 166.61 0.07 OUTLIER Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 119.543 1.065 . . . . 0.0 111.326 -166.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.07 -4.06 13.61 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.29 1.993 . . . . 0.0 112.299 -178.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.7 p -58.31 -78.86 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 128.673 2.789 . . . . 0.0 111.808 -171.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.47 153.38 28.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.31 121.09 16.18 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.051 1.34 . . . . 0.0 109.048 -169.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.1 m -135.36 160.92 66.18 Favored Pre-proline 0 C--O 1.24 0.601 0 C-N-CA 123.962 0.905 . . . . 0.0 110.241 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.46 171.37 13.1 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.335 2.023 . . . . 0.0 110.603 170.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.37 151.4 34.88 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.425 171.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.9 47.82 11.02 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 124.653 1.121 . . . . 0.0 111.122 174.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.6 m -151.4 26.28 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 125.796 1.638 . . . . 0.0 110.15 170.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -61.75 -16.9 53.4 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.577 2.066 . . . . 0.0 116.577 -151.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -144.71 14.34 1.55 Allowed 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 128.082 2.553 . . . . 0.0 111.445 -172.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -70.69 149.47 46.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.186 1.395 . . . . 0.0 109.666 -179.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.2 m -73.25 164.28 26.9 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.892 163.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -142.19 158.36 43.83 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.218 1.007 . . . . 0.0 109.947 166.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.71 136.29 54.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.577 1.551 . . . . 0.0 107.96 170.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.1 p -152.4 155.48 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-N 119.454 1.024 . . . . 0.0 109.524 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -90.1 121.77 32.46 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 120.109 1.322 . . . . 0.0 109.186 176.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.43 -10.16 41.17 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -166.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -117.39 2.89 12.52 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.838 1.255 . . . . 0.0 110.903 -178.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -135.55 38.53 2.87 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 128.86 2.864 . . . . 0.0 106.902 -179.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -64.74 -12.88 51.91 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 120.653 -1.279 . . . . 0.0 113.271 -163.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -107.83 3.81 24.79 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 127.94 2.496 . . . . 0.0 112.346 177.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.36 -78.37 0.98 Allowed Glycine 0 C--N 1.336 0.535 0 N-CA-C 110.239 -1.144 . . . . 0.0 110.239 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 20.7 m -121.64 156.81 32.21 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.463 1.105 . . . . 0.0 109.817 -174.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.4 tt -152.39 152.88 10.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.525 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 163.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 80.4 mt -133.59 117.79 28.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 172.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -84.17 153.87 23.42 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 170.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.7 p90 -155.34 162.85 40.73 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 120.924 -1.11 . . . . 0.0 110.265 165.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -145.12 129.11 17.48 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 117.971 0.35 . . . . 0.0 111.031 162.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.32 118.65 14.38 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.707 0.803 . . . . 0.0 109.865 164.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -131.23 76.01 1.69 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.752 2.421 . . . . 0.0 106.138 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.16 -129.46 9.68 Favored Glycine 0 C--N 1.338 0.686 0 C-N-CA 124.684 1.135 . . . . 0.0 112.142 174.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -88.45 22.29 2.59 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.107 1.453 . . . . 0.0 112.129 170.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 93.9 m -137.16 148.37 46.55 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.945 1.698 . . . . 0.0 108.082 176.068 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 61.5 t -118.76 129.03 75.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 167.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 19.8 mm -91.39 108.32 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 105.009 -2.219 . . . . 0.0 105.009 169.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.8 mt -89.85 141.96 13.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 173.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -136.34 100.43 4.38 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 125.473 1.509 . . . . 0.0 108.17 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 34.9 p90 -115.6 165.89 12.52 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 122.75 0.42 . . . . 0.0 111.034 -174.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.2 t -146.51 171.76 14.58 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 125.801 1.64 . . . . 0.0 107.573 172.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 53.0 p -106.45 19.7 20.11 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.399 1.479 . . . . 0.0 110.253 169.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -127.91 -171.46 2.45 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.775 0.83 . . . . 0.0 109.217 167.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.71 -25.56 23.4 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 169.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -142.65 15.76 1.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -149.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.9 p -119.03 -179.92 3.97 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 119.754 1.161 . . . . 0.0 113.762 -170.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -53.22 125.4 17.43 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 123.666 0.786 . . . . 0.0 110.099 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 58.6 mt -79.61 159.56 26.74 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 125.59 1.556 . . . . 0.0 109.043 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -82.08 177.4 8.84 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 125.162 1.385 . . . . 0.0 110.162 171.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.37 119.76 35.57 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.256 1.422 . . . . 0.0 109.948 171.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.3 tptt -144.83 132.62 21.17 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 170.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -138.85 105.45 5.33 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 106.195 -1.779 . . . . 0.0 106.195 -171.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -118.22 145.44 44.99 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -174.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 37.4 p -75.02 153.05 38.66 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.332 0.515 . . . . 0.0 111.917 176.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.3 mt -60.5 -23.94 64.92 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 121.814 -0.554 . . . . 0.0 110.515 168.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.94 -46.41 71.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.321 172.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -51.41 -65.39 0.56 Allowed 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.462 1.105 . . . . 0.0 110.304 176.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.74 -34.87 73.51 Favored 'General case' 0 CA--C 1.521 -0.137 0 C-N-CA 122.781 0.432 . . . . 0.0 111.878 -170.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -69.74 -34.03 73.27 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.906 -0.496 . . . . 0.0 109.834 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -53.92 12.29 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.982 174.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -53.43 -56.74 14.37 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.14 0.976 . . . . 0.0 110.706 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -124.09 11.62 8.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.167 0.987 . . . . 0.0 113.171 -160.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -143.99 23.46 1.7 Allowed 'General case' 0 CA--C 1.537 0.454 0 O-C-N 120.525 -1.359 . . . . 0.0 114.475 175.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.615 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -69.53 -40.29 76.99 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 120.27 -1.519 . . . . 0.0 114.418 -171.445 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.8 t -107.05 173.57 6.27 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 126.369 1.868 . . . . 0.0 109.048 -163.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 2.2 mtm-85 -79.65 -47.85 14.71 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 124.104 0.961 . . . . 0.0 112.593 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.0 m -57.42 -37.61 73.03 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.731 0.645 . . . . 0.0 110.519 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.615 HE22 ' NE2' ' A' ' 119' ' ' GLN . 15.1 tt0 -62.33 -29.79 70.7 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.454 -0.779 . . . . 0.0 111.796 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 29.4 mtpt -65.68 -33.49 76.01 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 118.047 -0.977 . . . . 0.0 109.801 -178.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -49.38 78.04 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 176.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -69.63 -56.84 6.14 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 118.633 -0.698 . . . . 0.0 110.202 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 53.5 t -49.32 -53.31 9.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 123.882 0.873 . . . . 0.0 110.826 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -71.59 -17.56 62.28 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.731 0.696 . . . . 0.0 112.043 -177.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -80.7 -29.94 36.44 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.24 -0.912 . . . . 0.0 111.126 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -64.37 -36.64 84.79 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 167.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 26.1 t -64.68 -23.47 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 121.04 -1.038 . . . . 0.0 110.653 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -89.73 15.32 9.87 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.782 -1.199 . . . . 0.0 112.25 174.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -136.23 9.31 4.12 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 124.693 1.139 . . . . 0.0 114.258 -174.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.2 22.88 11.93 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -161.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 19.2 mtt180 44.26 -164.04 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 130.675 3.59 . . . . 0.0 110.773 179.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.36 -5.12 0.39 Allowed 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 118.892 -1.123 . . . . 0.0 112.685 159.115 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 . . . . . 0 C--O 1.254 1.322 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 -173.016 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.147 0 N-CA-C 111.785 -0.526 . . . . 0.0 111.785 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 -66.98 5.08 0.72 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -175.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 6.3 ttp -61.57 -32.44 72.53 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.395 1.878 . . . . 0.0 113.792 -171.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.474 ' HG2' ' H ' ' A' ' 23' ' ' PHE . 19.1 tttp 54.77 -162.16 0.14 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.109 0.964 . . . . 0.0 112.337 169.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.474 ' H ' ' HG2' ' A' ' 22' ' ' LYS . 46.7 m-85 -103.06 160.68 14.41 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 148.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.545 ' HG1' ' NE2' ' A' ' 26' ' ' GLN . 22.0 p -120.26 170.68 9.11 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 165.394 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -62.65 -43.53 98.58 Favored 'General case' 0 C--O 1.233 0.22 0 O-C-N 121.743 -0.598 . . . . 0.0 110.078 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.545 ' NE2' ' HG1' ' A' ' 24' ' ' THR . 0.0 OUTLIER -60.38 -48.83 80.06 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 123.987 0.915 . . . . 0.0 109.977 179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.8 mm-40 -55.55 -47.36 76.46 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 125.49 1.516 . . . . 0.0 110.391 -175.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.4 mt -64.15 -33.41 62.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -178.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -65.88 -30.84 77.95 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-O 118.957 -0.913 . . . . 0.0 113.871 178.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 61.6 t -75.89 -44.75 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mp -55.42 -45.46 76.75 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.008 0.523 . . . . 0.0 110.449 173.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.46 -42.46 96.21 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.942 0.497 . . . . 0.0 111.672 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.33 -20.75 79.55 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 112.115 -0.394 . . . . 0.0 112.115 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.6 mp -69.77 -26.87 64.5 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.985 -1.303 . . . . 0.0 111.803 173.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.88 -27.56 36.26 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 171.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.3 mp -127.08 95.18 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -174.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m 67.51 63.5 0.73 Allowed Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.398 1.479 . . . . 0.0 113.009 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.94 -42.4 37.56 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.243 2.628 . . . . 0.0 111.721 176.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.12 -42.71 75.7 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.408 -0.807 . . . . 0.0 110.563 -173.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . 0.412 ' HA ' ' HG2' ' A' ' 43' ' ' GLN . 37.6 t90 -60.04 -37.58 80.21 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.087 0.555 . . . . 0.0 111.604 175.01 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.31 -63.32 1.34 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 172.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -55.13 -36.83 66.17 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 123.585 0.754 . . . . 0.0 112.286 -173.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.412 ' HG2' ' HA ' ' A' ' 40' ' ' TRP 0.252 1.5 pt20 -64.59 -45.15 88.2 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 118.193 0.452 . . . . 0.0 111.166 -176.32 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -69.06 -34.16 74.73 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 124.157 0.983 . . . . 0.0 110.616 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.7 mm -58.87 -45.18 91.82 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.494 166.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.03 -4.3 4.54 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -177.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.57 10.08 7.19 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.276 1.03 . . . . 0.0 111.658 170.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 49.14 31.29 3.42 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.439 2.295 . . . . 0.0 113.111 -173.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -91.13 3.37 54.95 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.196 1.799 . . . . 0.0 115.657 -174.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 55.5 tp -87.47 139.53 30.45 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.099 1.318 . . . . 0.0 110.758 -177.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 71.8 t -114.33 123.62 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 C-N-CA 124.856 1.263 . . . . 0.0 107.69 165.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -71.93 135.16 46.4 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.269 1.428 . . . . 0.0 107.791 156.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -147.24 167.59 28.44 Favored Glycine 0 C--N 1.333 0.406 0 CA-C-N 118.633 0.652 . . . . 0.0 112.281 175.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 20.0 mm -117.49 134.38 61.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 106.153 -1.795 . . . . 0.0 106.153 173.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 28.8 t -47.91 -71.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 C-N-CA 128.194 2.597 . . . . 0.0 110.089 179.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 21.2 mttt 58.65 159.03 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.517 0 C-N-CA 127.115 2.166 . . . . 0.0 113.276 -166.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.69 -12.32 30.95 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 121.872 1.715 . . . . 0.0 111.732 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -60.87 -14.18 20.43 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.214 1.405 . . . . 0.0 112.509 175.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -131.38 -173.53 3.14 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 120.237 1.381 . . . . 0.0 112.264 -173.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 24.6 m -129.2 101.69 6.13 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.744 1.218 . . . . 0.0 107.803 -149.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.9 m -142.96 157.19 61.49 Favored Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 124.977 1.311 . . . . 0.0 110.859 -154.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -67.24 172.04 10.63 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 122.279 1.986 . . . . 0.0 111.573 175.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.52 141.33 57.91 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.775 0.83 . . . . 0.0 111.366 176.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.61 43.16 45.0 Favored Glycine 0 CA--C 1.485 -1.791 0 C-N-CA 124.299 0.952 . . . . 0.0 113.234 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.252 1.6 p -170.37 80.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.416 -2.135 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 177.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -98.82 -6.64 28.82 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.015 -1.448 . . . . 0.0 112.235 162.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -152.4 -1.64 0.27 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -168.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -67.92 115.66 7.69 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 119.657 1.117 . . . . 0.0 108.343 178.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -53.8 139.16 33.98 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.777 1.231 . . . . 0.0 109.948 -177.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 22.3 p90 -122.38 167.15 13.64 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.353 0.661 . . . . 0.0 112.665 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 54.0 mt -143.22 125.71 15.77 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 127.336 2.254 . . . . 0.0 106.47 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.6 p -157.39 155.52 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 125.144 1.378 . . . . 0.0 108.397 -178.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.87 157.17 16.92 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.416 1.007 . . . . 0.0 110.422 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.01 -25.62 63.82 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 -166.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -106.71 -8.65 16.77 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 124.549 1.14 . . . . 0.0 112.339 -174.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.6 p30 -123.48 32.55 5.6 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.905 0.882 . . . . 0.0 109.233 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -51.72 -22.42 3.5 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.197 0.999 . . . . 0.0 113.556 173.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -116.47 6.43 13.57 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.77 1.628 . . . . 0.0 112.877 175.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.82 -126.13 1.75 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 126.39 1.948 . . . . 0.0 110.553 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.0 m -64.2 160.1 19.24 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 170.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.2 tt -157.46 147.8 10.24 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 160.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 88.9 mt -126.99 135.46 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -119.61 157.14 29.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 126.012 1.725 . . . . 0.0 106.983 176.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -159.72 153.81 23.4 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 120.425 -1.422 . . . . 0.0 108.906 172.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.79 110.68 13.36 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 166.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.74 84.32 0.9 Allowed 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 161.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -75.96 -169.53 1.14 Allowed 'General case' 0 C--O 1.24 0.555 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.62 104.56 0.39 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 124.19 0.9 . . . . 0.0 111.007 178.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 62.55 14.72 7.3 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.323 1.449 . . . . 0.0 111.614 168.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.0 m -144.44 138.96 28.06 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.571 1.948 . . . . 0.0 107.985 -172.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 18.5 t -115.38 112.03 38.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 169.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.2 mp -86.64 104.12 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 N-CA-C 105.726 -1.953 . . . . 0.0 105.726 166.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 mt -86.54 113.78 24.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -108.4 98.7 8.19 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 126.32 1.848 . . . . 0.0 108.63 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -124.25 165.89 16.85 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 119.925 -1.735 . . . . 0.0 110.533 -175.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.5 t -154.22 171.27 19.47 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.635 1.574 . . . . 0.0 108.774 -177.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.5 -11.74 19.07 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.651 1.58 . . . . 0.0 111.288 174.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -147.6 145.51 29.03 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.15 176.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.0 tpt85 -53.8 -41.35 67.2 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.139 0.976 . . . . 0.0 109.796 173.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.416 HD21 ' C ' ' A' ' 100' ' ' ASN . 0.1 OUTLIER -78.56 26.68 0.22 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.489 1.515 . . . . 0.0 114.94 176.382 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.95 158.6 43.9 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 119.753 -1.842 . . . . 0.0 112.131 172.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.4 tptm -63.29 166.68 6.02 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 124.397 1.079 . . . . 0.0 109.616 169.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 26.5 mt -105.88 156.52 18.27 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 125.822 1.649 . . . . 0.0 108.613 -172.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -71.79 -179.28 2.59 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.652 1.181 . . . . 0.0 109.563 165.168 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -142.99 70.84 1.33 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.18 0.992 . . . . 0.0 108.647 167.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -70.64 101.14 1.98 Allowed 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 170.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -95.3 136.29 35.84 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 175.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 29.1 mt -146.89 153.95 40.73 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.391 1.876 . . . . 0.0 106.334 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 11.9 p -76.53 154.8 34.25 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.501 -0.749 . . . . 0.0 111.2 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 11.8 mt -59.96 -25.52 65.26 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.188 -0.945 . . . . 0.0 110.531 169.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.23 -46.29 70.91 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 117.264 -1.35 . . . . 0.0 112.607 170.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.95 -60.19 2.4 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.067 1.347 . . . . 0.0 110.079 177.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.17 -42.22 85.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.345 1.458 . . . . 0.0 110.54 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -66.44 -34.07 77.12 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.471 -0.768 . . . . 0.0 110.257 -178.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.15 -66.58 0.54 Allowed 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 175.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -49.74 -42.15 45.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 126.584 1.954 . . . . 0.0 114.333 -166.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -128.1 18.51 6.56 Favored 'General case' 0 C--O 1.226 -0.146 0 CA-C-N 118.181 0.446 . . . . 0.0 111.636 -173.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -142.71 17.17 1.99 Allowed 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.631 -0.668 . . . . 0.0 111.359 177.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.59 ' NE2' HE22 ' A' ' 123' ' ' GLN . 2.6 pm0 -51.05 -74.13 0.03 OUTLIER 'General case' 0 C--N 1.351 0.663 0 CA-C-N 119.313 0.961 . . . . 0.0 111.801 165.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.64 151.04 27.8 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 -169.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 62.5 ttt-85 -75.86 -21.43 57.22 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-O 117.702 -1.142 . . . . 0.0 112.382 173.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 1.4 t -59.66 -50.25 74.6 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 119.933 1.242 . . . . 0.0 108.179 175.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.59 HE22 ' NE2' ' A' ' 119' ' ' GLN . 2.9 pt20 -61.65 -24.89 67.02 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.229 0.468 . . . . 0.0 111.917 -177.669 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -69.93 -5.19 24.36 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 118.031 -0.985 . . . . 0.0 112.677 176.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? -70.97 -75.54 0.12 Allowed 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 155.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -55.57 -47.3 76.64 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -162.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 71.2 t -55.1 -51.36 55.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 125.091 1.356 . . . . 0.0 110.194 177.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.17 -27.42 60.81 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.93 0.892 . . . . 0.0 110.926 -177.155 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.61 -51.26 70.56 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.543 2.337 . . . . 0.0 108.542 169.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -57.31 -27.96 62.64 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.577 0.751 . . . . 0.0 111.394 -178.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 60.2 t -75.36 -25.62 18.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 O-C-N 121.205 -0.935 . . . . 0.0 112.171 177.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -90.8 -18.11 25.46 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.457 -0.777 . . . . 0.0 111.159 173.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.31 9.91 73.4 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.063 1.316 . . . . 0.0 114.658 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.8 pp -104.65 167.64 9.6 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.968 1.307 . . . . 0.0 111.667 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 49.8 mtp85 -109.53 176.71 4.98 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 125.47 1.508 . . . . 0.0 108.671 172.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.82 3.94 1.87 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.752 0.421 . . . . 0.0 111.216 -169.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 . . . . . 0 C--O 1.246 0.915 0 C-N-CA 129.113 2.965 . . . . 0.0 109.839 -158.987 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.806 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.8 m80 55.27 178.23 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.176 1.79 . . . . 0.0 113.332 -165.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 43.9 mmm -48.59 103.95 0.05 Allowed 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 126.937 2.095 . . . . 0.0 108.779 169.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -150.59 -172.76 4.27 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 174.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.58 -166.23 2.34 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 171.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.15 137.71 54.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.508 1.523 . . . . 0.0 107.956 175.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -69.58 -40.09 76.94 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.757 -0.59 . . . . 0.0 110.282 -166.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 mm100 -45.6 -51.05 12.62 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.37 1.468 . . . . 0.0 110.231 165.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -69.59 -37.39 76.9 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.561 1.144 . . . . 0.0 112.053 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.7 mt -62.52 -36.49 75.21 Favored 'Isoleucine or valine' 0 C--N 1.342 0.278 0 CA-C-N 120.499 1.5 . . . . 0.0 110.909 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -51.85 -48.13 51.83 Favored Glycine 0 C--N 1.336 0.571 0 CA-C-N 119.65 1.113 . . . . 0.0 112.827 -174.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.4 t -62.26 -46.23 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-N 117.226 0.513 . . . . 0.0 110.084 -178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 80.6 mt -70.68 -34.09 71.61 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.327 0.651 . . . . 0.0 111.436 -176.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.26 -48.46 78.08 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.04 0.936 . . . . 0.0 109.631 171.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.75 -34.62 78.15 Favored Glycine 0 C--N 1.336 0.578 0 N-CA-C 111.644 -0.582 . . . . 0.0 111.644 175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.1 mt -63.78 -31.06 72.11 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 120.607 -1.525 . . . . 0.0 110.794 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.14 -19.14 57.27 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 117.592 -1.194 . . . . 0.0 113.252 172.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.0 mm -144.4 93.0 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 125.905 1.682 . . . . 0.0 108.085 -163.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t 56.27 71.66 1.15 Allowed Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 126.5 1.92 . . . . 0.0 111.629 -171.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -60.58 -42.88 36.42 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.447 2.098 . . . . 0.0 109.208 171.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.86 -56.23 13.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.195 1.398 . . . . 0.0 110.99 177.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 69.3 t90 -53.07 -53.21 53.66 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.543 0.61 . . . . 0.0 110.214 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.7 tt -59.1 -48.26 82.26 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 118.438 0.563 . . . . 0.0 110.678 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.0 mttm -56.0 -45.55 79.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 118.679 0.672 . . . . 0.0 110.589 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -69.3 -39.57 78.22 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -175.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -65.27 -46.84 78.85 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.391 -0.818 . . . . 0.0 111.257 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.6 mm -60.87 -35.29 63.71 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.114 0 C-N-CA 123.9 0.88 . . . . 0.0 110.416 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.48 -39.76 58.16 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.03 0.832 . . . . 0.0 111.319 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -100.98 6.23 43.45 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.013 1.725 . . . . 0.0 113.302 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 54.27 19.39 2.19 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.199 1.799 . . . . 0.0 112.147 -171.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -83.25 10.01 9.41 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 119.984 -1.698 . . . . 0.0 112.128 -178.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.4 tp -84.85 145.92 27.58 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 171.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.5 p -128.45 165.52 27.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 125.119 1.368 . . . . 0.0 108.876 167.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -134.11 159.31 41.23 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 128.874 2.87 . . . . 0.0 105.801 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.59 175.51 43.98 Favored Glycine 0 CA--C 1.517 0.184 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 177.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 42.2 mm -113.8 134.68 55.84 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.715 0 C-N-CA 126.463 1.905 . . . . 0.0 106.589 178.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.496 HG22 ' H ' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -44.51 -82.96 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.421 -1.919 1 C-N-CA 132.063 4.145 . . . . 0.0 111.718 169.067 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.496 ' H ' HG22 ' A' ' 55' ' ' VAL . 15.1 mmtt 60.33 166.24 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 124.838 1.255 . . . . 0.0 112.551 -173.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -65.08 -6.91 13.94 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.341 2.027 . . . . 0.0 115.256 167.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.2 m -91.92 -48.52 6.72 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 120.086 1.312 . . . . 0.0 113.872 -166.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.73 169.89 16.41 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.385 0.993 . . . . 0.0 108.972 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.8 m -80.13 108.52 13.79 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 174.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.6 m -131.89 163.19 51.7 Favored Pre-proline 0 C--O 1.238 0.472 0 C-N-CA 125.292 1.437 . . . . 0.0 108.972 167.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -75.6 164.06 32.91 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 121.572 1.515 . . . . 0.0 111.695 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.13 123.43 15.24 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.332 169.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 105.35 26.92 6.03 Favored Glycine 0 CA--C 1.529 0.911 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.026 172.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.1 m -144.21 81.77 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.51 1.524 . . . . 0.0 108.478 172.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -89.85 -14.42 34.39 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.15 1.908 . . . . 0.0 116.15 -172.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -165.32 14.9 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 126.863 2.065 . . . . 0.0 110.599 -176.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -77.13 110.12 11.55 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.3 m -49.99 139.05 14.5 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.36 0.664 . . . . 0.0 109.483 168.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.8 p90 -112.29 170.38 8.21 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.099 0.863 . . . . 0.0 110.703 174.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.9 mt -135.3 135.9 41.18 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.0 2.12 . . . . 0.0 106.241 169.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.418 ' HB ' HG13 ' A' ' 81' ' ' ILE . 4.1 p -144.41 162.24 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 CA-C-N 119.398 0.999 . . . . 0.0 108.727 175.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.67 122.82 28.64 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 172.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.06 -30.76 71.34 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 119.085 0.857 . . . . 0.0 110.906 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.85 -10.13 29.7 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 124.359 1.064 . . . . 0.0 112.236 -176.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.16 53.73 1.96 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 176.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -47.72 -46.4 29.63 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.918 -0.489 . . . . 0.0 112.271 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -85.75 2.63 44.74 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.937 1.295 . . . . 0.0 111.969 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.5 -69.13 1.36 Allowed Glycine 0 CA--C 1.532 1.097 0 C-N-CA 126.261 1.886 . . . . 0.0 113.893 -165.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.7 m -143.47 158.72 43.42 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.451 1.5 . . . . 0.0 109.206 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.418 HG13 ' HB ' ' A' ' 72' ' ' VAL . 7.3 tt -155.51 155.11 5.97 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-N 119.315 0.961 . . . . 0.0 109.118 177.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.4 mt -139.02 150.59 23.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 175.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -128.86 153.77 47.14 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 126.202 1.801 . . . . 0.0 107.592 171.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -152.03 158.5 43.15 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.819 1.248 . . . . 0.0 109.793 175.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.3 tttt -155.62 125.53 6.53 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 123.996 0.919 . . . . 0.0 108.898 176.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.2 158.15 32.03 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.141 0.428 . . . . 0.0 110.646 167.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -137.87 -3.65 1.81 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 177.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 113.17 81.46 1.07 Allowed Glycine 0 C--N 1.338 0.643 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 75.44 7.55 3.96 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.189 2.596 . . . . 0.0 114.527 -173.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.1 m -141.0 160.49 39.96 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.714 1.605 . . . . 0.0 108.064 174.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 87.9 t -134.23 139.77 47.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 C-N-CA 126.324 1.85 . . . . 0.0 106.371 174.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 23.8 mm -103.15 114.82 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 173.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.8 mt -94.12 130.91 42.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 173.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -125.02 97.71 5.37 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 126.994 2.118 . . . . 0.0 107.192 -176.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 25.0 p90 -124.76 169.79 11.66 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.508 -1.37 . . . . 0.0 110.094 -171.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.4 t -154.31 168.36 26.85 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.301 0.64 . . . . 0.0 109.498 176.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.0 p -91.1 -10.59 41.44 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.779 1.632 . . . . 0.0 112.244 170.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -147.17 123.25 10.78 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.385 1.074 . . . . 0.0 110.236 -170.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 -51.99 -36.03 48.46 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 125.113 1.365 . . . . 0.0 111.695 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.03 -3.48 32.75 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.947 1.699 . . . . 0.0 114.925 -173.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.4 p -119.95 171.92 8.1 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -162.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.05 152.03 41.4 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 121.287 -0.883 . . . . 0.0 109.264 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -85.53 135.37 33.85 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 172.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.72 176.12 0.41 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.266 1.427 . . . . 0.0 109.391 162.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.28 106.0 4.48 Favored 'General case' 0 C--O 1.232 0.181 0 O-C-N 121.355 -0.84 . . . . 0.0 109.561 -175.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.5 tppt? -121.66 108.08 13.13 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 106.363 -1.718 . . . . 0.0 106.363 171.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -81.27 140.74 34.67 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 169.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -135.3 135.96 41.23 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 106.819 -1.548 . . . . 0.0 106.819 171.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.37 153.81 33.94 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.718 0.807 . . . . 0.0 109.648 172.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.0 mt -55.68 -43.12 76.06 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.268 -1.52 . . . . 0.0 108.46 166.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.9 t -51.67 -55.09 21.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.902 -0.57 . . . . 0.0 109.959 177.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -44.53 -66.34 0.4 Allowed 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 127.568 2.347 . . . . 0.0 110.48 175.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 83.4 mt -64.14 -31.65 72.93 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.665 -175.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -70.29 -39.71 74.71 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.959 -1.088 . . . . 0.0 108.225 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -51.02 61.16 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 117.885 -1.055 . . . . 0.0 108.623 174.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -55.68 -44.81 77.65 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 118.774 0.715 . . . . 0.0 111.705 -174.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -141.85 16.36 2.13 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -157.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -148.49 42.01 0.98 Allowed 'General case' 0 C--O 1.238 0.453 0 O-C-N 120.049 -1.657 . . . . 0.0 111.496 175.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.5 -26.47 13.23 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -170.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 41.5 p -92.49 -174.97 3.85 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.167 1.387 . . . . 0.0 109.765 -178.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.29 -46.64 4.96 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 120.545 -1.347 . . . . 0.0 110.768 -176.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 70.4 m -63.0 -31.01 72.05 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 119.133 0.879 . . . . 0.0 111.297 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -62.12 -16.83 55.23 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.75 -1.219 . . . . 0.0 112.9 177.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -65.35 -25.07 67.43 Favored 'General case' 0 N--CA 1.462 0.166 0 O-C-N 121.368 -0.832 . . . . 0.0 111.014 172.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -77.33 -67.67 0.69 Allowed 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 168.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -53.65 -51.76 62.12 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 124.458 1.098 . . . . 0.0 112.57 -157.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 36.4 t -53.2 -55.48 12.38 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 C-N-CA 123.997 0.919 . . . . 0.0 109.216 178.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -67.59 -28.23 67.58 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -176.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -65.35 -38.32 89.75 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 124.553 1.141 . . . . 0.0 109.757 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 9.2 m-30 -62.47 -33.47 74.92 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.695 0.798 . . . . 0.0 111.146 169.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 11.2 t -70.24 -16.08 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 120.569 -1.332 . . . . 0.0 111.242 173.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -107.83 18.01 21.82 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.086 1.355 . . . . 0.0 110.757 173.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -122.39 18.98 8.18 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 125.658 1.599 . . . . 0.0 111.252 175.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.8 pp -125.48 151.23 46.56 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.279 1.032 . . . . 0.0 111.35 -178.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 19.1 mtt85 -72.32 178.5 3.9 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 126.98 2.112 . . . . 0.0 108.951 170.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.88 -0.89 2.05 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -175.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.256 1.417 0 C-N-CA 126.485 1.914 . . . . 0.0 108.138 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.125 -0.79 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -134.24 -55.34 0.86 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.295 1.438 . . . . 0.0 111.808 -175.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 27.4 ptm -122.6 -22.11 5.5 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.553 0.741 . . . . 0.0 111.983 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.5 mttm -79.54 101.27 8.17 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 168.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 61.39 169.3 0.1 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 126.695 1.998 . . . . 0.0 112.732 -169.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.743 ' HG1' ' NE2' ' A' ' 26' ' ' GLN . 16.6 p -129.69 154.59 47.0 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 104.711 -2.329 . . . . 0.0 104.711 162.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -63.75 -32.64 74.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.768 0.258 . . . . 0.0 110.406 -170.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.743 ' NE2' ' HG1' ' A' ' 24' ' ' THR . 0.1 OUTLIER -58.63 -47.71 83.47 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.056 0.943 . . . . 0.0 111.252 175.433 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -62.76 -45.8 91.02 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.366 1.066 . . . . 0.0 109.289 -175.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 28.5 mt -61.52 -44.7 99.04 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 C-N-CA 124.817 1.247 . . . . 0.0 108.342 179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.57 -37.57 56.64 Favored Glycine 0 CA--C 1.523 0.562 0 C-N-CA 124.168 0.89 . . . . 0.0 111.881 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 75.5 t -64.73 -59.77 3.71 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.137 0 CA-C-N 118.47 1.135 . . . . 0.0 109.042 173.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 33.9 mt -58.36 -42.48 87.03 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.432 1.014 . . . . 0.0 110.787 -172.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.26 93.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.64 1.176 . . . . 0.0 111.45 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.82 -25.19 75.85 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 118.164 0.438 . . . . 0.0 112.342 175.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.1 mt -69.99 -41.09 74.84 Favored 'General case' 0 C--O 1.231 0.125 0 O-C-N 120.449 -1.618 . . . . 0.0 110.008 173.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.33 -32.13 73.47 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 119.212 -0.423 . . . . 0.0 111.312 173.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 32.1 mm -126.75 97.74 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 125.908 1.683 . . . . 0.0 107.889 -170.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.276 1.0 OUTLIER 65.83 67.67 0.72 Allowed Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.066 1.746 . . . . 0.0 112.559 173.129 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.79 -35.73 9.16 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.261 2.641 . . . . 0.0 113.285 -176.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -58.97 -58.93 6.47 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.275 1.03 . . . . 0.0 110.104 -177.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 48.8 t90 -47.7 -49.7 27.17 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.481 1.512 . . . . 0.0 111.203 175.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.7 tt -58.86 -47.56 84.48 Favored 'General case' 0 C--N 1.34 0.155 0 O-C-N 121.624 -0.672 . . . . 0.0 110.343 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -63.24 -38.5 91.4 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 117.841 -1.076 . . . . 0.0 111.606 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -61.44 -40.1 93.23 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 119.625 1.102 . . . . 0.0 109.775 176.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -75.24 -45.51 39.73 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.16 -175.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.91 -45.3 98.52 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-N 119.487 1.039 . . . . 0.0 109.627 176.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.29 -39.26 72.41 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.807 0.73 . . . . 0.0 110.306 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.93 0.79 46.43 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 44.41 45.54 7.53 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 126.463 1.905 . . . . 0.0 111.003 -168.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.514 ' HA ' HE21 ' A' ' 49' ' ' GLN . 0.0 OUTLIER -104.82 -2.31 24.93 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 177.445 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.0 tp -85.5 119.17 25.56 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 120.175 1.352 . . . . 0.0 110.638 -171.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 42.9 t -107.4 120.51 58.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 C-N-CA 125.544 1.538 . . . . 0.0 109.034 -178.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -89.94 153.3 20.72 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 128.124 2.57 . . . . 0.0 108.66 165.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -178.94 175.2 47.17 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 27.7 mm -115.12 136.3 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 124.599 1.159 . . . . 0.0 108.283 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 t -53.4 -75.82 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 129.925 3.29 . . . . 0.0 111.349 -175.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.0 mttt 59.27 167.37 0.08 OUTLIER Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 123.984 0.914 . . . . 0.0 112.191 -172.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.98 -4.47 8.93 Favored 'Trans proline' 0 CA--C 1.549 1.253 0 CA-C-N 121.104 1.43 . . . . 0.0 112.747 169.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.1 m -81.04 3.94 21.45 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 126.44 1.896 . . . . 0.0 114.989 -168.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.19 -175.42 4.1 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 120.002 1.273 . . . . 0.0 111.335 171.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.9 t -75.51 143.8 42.32 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 162.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -160.64 157.62 23.87 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 124.316 1.046 . . . . 0.0 110.296 165.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.36 -177.99 3.67 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 123.891 3.061 . . . . 0.0 111.379 174.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.71 137.2 40.47 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 123.639 0.776 . . . . 0.0 112.567 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.15 60.75 6.78 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 125.131 1.348 . . . . 0.0 109.874 173.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -144.16 30.59 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 125.536 1.535 . . . . 0.0 109.785 165.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -55.19 -15.76 2.6 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 117.7 2.481 . . . . 0.0 117.7 -160.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -154.6 26.74 0.45 Allowed 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.362 1.465 . . . . 0.0 110.488 171.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -71.96 108.85 5.42 Favored 'General case' 0 CA--C 1.519 -0.234 0 O-C-N 121.321 -0.862 . . . . 0.0 108.742 174.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.4 m -50.24 137.69 17.7 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.235 1.414 . . . . 0.0 109.846 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 23.8 p90 -118.97 160.8 21.32 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 118.71 0.686 . . . . 0.0 111.33 -177.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.0 mt -135.82 133.78 38.2 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 127.566 2.346 . . . . 0.0 106.43 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.9 p -161.72 167.87 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 105.161 -2.163 . . . . 0.0 105.161 -169.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.06 -175.93 4.83 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.999 -1.063 . . . . 0.0 108.67 169.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -93.18 -14.46 27.12 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.6 -0.688 . . . . 0.0 112.759 161.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -139.28 22.21 2.57 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.932 0.893 . . . . 0.0 112.166 -161.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -138.17 34.45 2.33 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.8 1.64 . . . . 0.0 107.926 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -60.99 -18.79 59.52 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 119.651 -1.905 . . . . 0.0 113.473 -160.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -98.73 3.47 47.63 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.786 1.634 . . . . 0.0 113.779 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -94.96 -128.84 5.53 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 125.931 1.729 . . . . 0.0 111.679 -171.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 25.4 m -70.75 156.28 39.71 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.595 -0.944 . . . . 0.0 109.069 173.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.3 tt -151.03 158.92 4.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 164.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 57.9 mt -136.07 143.12 36.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 106.055 -1.831 . . . . 0.0 106.055 174.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -122.21 154.98 36.78 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 172.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -156.69 158.82 37.65 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.24 -0.912 . . . . 0.0 108.918 169.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.4 tttt -142.19 109.35 5.54 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 160.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -82.69 149.93 27.05 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 165.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -141.64 -154.12 0.5 Allowed 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 128.352 2.661 . . . . 0.0 107.144 -171.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -68.97 89.29 0.24 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 125.073 1.32 . . . . 0.0 110.026 -176.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 62.22 11.0 4.13 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.989 2.116 . . . . 0.0 114.149 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.89 162.9 24.83 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.515 1.507 . . . . 0.0 108.934 174.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 8.4 p -146.82 151.86 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.145 0 C-N-CA 124.811 1.245 . . . . 0.0 108.06 168.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.4 mp -116.53 109.45 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 166.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.2 mt -83.04 127.54 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 165.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 75.7 mttt -120.15 105.29 10.84 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.417 1.887 . . . . 0.0 109.017 178.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 26.7 p90 -126.02 167.68 14.99 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.858 -1.151 . . . . 0.0 110.461 -176.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -156.79 163.59 39.06 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.574 1.55 . . . . 0.0 107.303 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 45.5 p -82.21 -17.32 46.54 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 169.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -145.43 133.17 21.08 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.94 -41.58 11.76 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 129.38 3.072 . . . . 0.0 111.312 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -81.66 7.16 13.07 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -175.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.8 p -136.71 132.61 35.11 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.018 -1.677 . . . . 0.0 111.914 -169.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.65 147.27 11.67 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.432 1.093 . . . . 0.0 112.712 -166.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -71.1 163.61 27.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.568 1.547 . . . . 0.0 111.79 -172.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.3 mptp? -84.17 177.39 8.24 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 127.454 2.302 . . . . 0.0 109.332 167.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -123.95 118.81 27.88 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.221 1.808 . . . . 0.0 107.955 171.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -127.62 126.47 42.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 103.967 -2.605 . . . . 0.0 103.967 164.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -123.86 130.29 52.36 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 120.924 1.693 . . . . 0.0 108.914 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 29.2 mt -134.48 155.88 49.59 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 -173.153 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.5 p -87.18 151.0 23.56 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 121.282 1.856 . . . . 0.0 109.107 170.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 16.6 mt -58.66 -40.4 83.38 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-O 121.762 0.791 . . . . 0.0 109.755 -176.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.3 -37.33 82.82 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 124.407 1.083 . . . . 0.0 110.914 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -57.77 11.09 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 125.931 1.692 . . . . 0.0 112.255 173.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . 0.559 ' HA ' ' CG ' ' A' ' 116' ' ' GLU . 14.7 mt -56.35 -33.01 65.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.702 1.137 . . . . 0.0 110.136 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -72.59 12.1 0.53 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.127 1.371 . . . . 0.0 113.713 175.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.26 -35.02 1.04 Allowed 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.945 1.698 . . . . 0.0 110.86 -176.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.559 ' CG ' ' HA ' ' A' ' 113' ' ' LEU . 2.4 pt-20 -61.91 -86.41 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 154.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.456 ' CD2' ' HB2' ' A' ' 116' ' ' GLU . 98.7 m-85 -90.82 18.57 6.37 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.724 0.773 . . . . 0.0 110.233 -162.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -147.23 100.18 3.24 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 174.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -132.33 -33.56 1.28 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.8 t -130.95 143.31 50.63 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 120.827 1.649 . . . . 0.0 110.441 -168.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -62.14 -36.59 82.26 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 119.756 -1.84 . . . . 0.0 112.334 -171.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 26.9 t -62.52 -20.1 64.28 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 117.23 -1.367 . . . . 0.0 112.934 176.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -66.32 -23.37 66.35 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 121.046 1.748 . . . . 0.0 111.508 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.7 mttt -60.61 -6.35 1.63 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 126.335 1.854 . . . . 0.0 113.342 -175.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -104.56 -8.82 18.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 122.903 1.335 . . . . 0.0 114.122 -176.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.95 -62.66 1.56 Allowed 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 127.272 2.229 . . . . 0.0 108.916 176.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.8 t -57.69 -42.77 82.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 124.409 1.084 . . . . 0.0 111.467 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -76.27 -13.79 60.15 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 171.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -79.47 -41.72 26.87 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 125.051 1.34 . . . . 0.0 112.849 -179.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -59.02 -29.23 67.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.912 0.485 . . . . 0.0 110.29 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.3 t -67.03 -26.82 37.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 123.926 0.89 . . . . 0.0 111.437 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -96.96 -16.46 20.62 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.82 0.736 . . . . 0.0 111.849 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.43 -7.38 76.13 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.705 0.684 . . . . 0.0 112.878 -179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -84.81 176.19 8.67 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.902 1.281 . . . . 0.0 109.757 167.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -139.06 165.85 26.05 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 127.101 2.16 . . . . 0.0 108.368 -175.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.11 21.52 6.26 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.838 0.855 . . . . 0.0 110.459 178.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 . . . . . 0 C--O 1.251 1.153 0 C-N-CA 129.839 3.256 . . . . 0.0 110.249 -160.288 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.756 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 43.3 m80 -53.73 -72.79 0.05 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.071 0.948 . . . . 0.0 112.157 -174.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 46.7 mtp -81.46 175.92 10.13 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.744 -0.598 . . . . 0.0 111.358 -174.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -121.53 168.18 12.03 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.171 1.388 . . . . 0.0 108.046 160.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 57.54 -168.61 0.12 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.135 1.374 . . . . 0.0 109.498 -173.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.6 146.6 48.11 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 128.075 2.55 . . . . 0.0 106.143 171.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -55.86 -39.89 72.13 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.867 0.467 . . . . 0.0 110.45 -171.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -45.48 94.56 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.175 0.898 . . . . 0.0 110.511 -176.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.5 mm-40 -61.01 -34.93 75.59 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 124.835 1.254 . . . . 0.0 110.817 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 96.6 mt -74.05 -41.14 52.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 C-N-CA 124.517 1.127 . . . . 0.0 109.748 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.58 -42.49 90.49 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 124.967 1.27 . . . . 0.0 111.797 -175.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.3 t -60.82 -45.45 97.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-N 117.107 0.454 . . . . 0.0 110.742 176.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 46.1 mt -63.61 -45.37 90.61 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.933 0.788 . . . . 0.0 109.593 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.54 -47.45 73.16 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.386 1.075 . . . . 0.0 110.251 176.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.41 -22.67 78.81 Favored Glycine 0 CA--C 1.523 0.579 0 O-C-N 121.696 -0.627 . . . . 0.0 112.504 178.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 tp -69.61 -17.79 63.56 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.052 1.926 . . . . 0.0 112.207 174.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -91.26 -20.88 21.43 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 117.012 -1.47 . . . . 0.0 113.083 170.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.5 mp -134.28 105.58 6.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 -176.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.287 2.3 p 57.31 62.06 5.9 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.665 1.986 . . . . 0.0 112.141 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.41 -42.14 7.82 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.914 3.076 . . . . 0.0 111.016 176.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.57 -51.38 63.05 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -172.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -45.62 -48.13 14.7 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.873 0.869 . . . . 0.0 111.194 168.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.7 -52.59 63.69 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 -175.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -64.38 -32.99 74.82 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.132 0.973 . . . . 0.0 112.321 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -62.42 -52.06 65.05 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 119.887 1.221 . . . . 0.0 108.29 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -66.55 -37.44 84.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 117.972 -1.013 . . . . 0.0 111.875 -176.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 31.5 mm -59.19 -51.04 77.26 Favored 'Isoleucine or valine' 0 C--N 1.342 0.26 0 CA-C-N 119.777 1.171 . . . . 0.0 109.441 172.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.38 -38.14 79.74 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.992 0.815 . . . . 0.0 111.068 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.07 -8.3 55.12 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.299 1.04 . . . . 0.0 113.134 176.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 48.05 37.47 7.89 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.62 1.568 . . . . 0.0 112.016 -166.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.5 -6.66 21.56 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.456 1.502 . . . . 0.0 112.288 -177.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.26 128.85 35.88 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -173.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.6 t -114.31 156.49 15.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 174.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -123.31 145.25 48.87 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 127.423 2.289 . . . . 0.0 106.777 176.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -158.01 175.11 35.3 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 121.76 0.644 . . . . 0.0 113.451 -178.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mm -123.02 135.92 61.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.599 0 CA-C-O 124.808 2.242 . . . . 0.0 107.423 177.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.449 HG21 ' H ' ' A' ' 68' ' ' TYR . 0.8 OUTLIER -68.03 -59.18 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.809 0 C-N-CA 131.282 3.833 . . . . 0.0 109.817 -177.346 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 56.52 165.23 0.07 OUTLIER Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 127.681 2.392 . . . . 0.0 113.34 -170.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.25 80.54 1.01 Allowed 'Trans proline' 0 N--CA 1.448 -1.182 0 N-CA-C 107.528 -1.758 . . . . 0.0 107.528 155.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.5 t -159.1 -72.72 0.08 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.309 -1.738 . . . . 0.0 106.309 162.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.89 160.84 7.18 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 123.525 0.73 . . . . 0.0 112.611 -164.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 m -66.42 112.03 3.85 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 172.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 8.5 m -140.0 160.58 59.89 Favored Pre-proline 0 C--O 1.238 0.488 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.28 168.02 18.84 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.37 2.047 . . . . 0.0 110.794 171.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.11 132.86 49.48 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 171.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 99.7 37.32 3.99 Favored Glycine 0 CA--C 1.492 -1.395 0 CA-C-O 118.399 -1.223 . . . . 0.0 114.198 170.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.448 ' CG2' ' HB2' ' A' ' 68' ' ' TYR 0.296 1.6 p -174.1 56.17 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 CA-C-O 123.018 1.39 . . . . 0.0 107.701 -168.175 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -86.76 -4.52 59.19 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.732 1.613 . . . . 0.0 112.011 177.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -164.51 20.48 0.06 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.031 2.132 . . . . 0.0 110.719 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.449 ' H ' HG21 ' A' ' 55' ' ' VAL . 4.5 m-85 -83.69 100.18 10.71 Favored 'General case' 0 CA--C 1.52 -0.185 0 C-N-CA 126.128 1.771 . . . . 0.0 109.241 174.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -44.2 139.96 2.36 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 127.096 2.158 . . . . 0.0 111.86 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -127.12 166.93 16.72 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.485 1.114 . . . . 0.0 112.731 -175.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 19.1 mt -139.16 124.9 19.59 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 127.387 2.275 . . . . 0.0 106.347 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -150.59 143.47 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 126.138 1.775 . . . . 0.0 106.463 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.1 156.15 34.11 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 169.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.95 -24.32 62.44 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -174.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -111.46 3.73 18.33 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.434 1.894 . . . . 0.0 110.952 -174.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -101.27 19.82 16.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.203 1.801 . . . . 0.0 111.23 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -44.97 -43.34 8.99 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 126.532 1.933 . . . . 0.0 113.693 -169.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -124.99 13.78 8.46 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.662 1.185 . . . . 0.0 111.479 170.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.67 -68.65 1.52 Allowed Glycine 0 CA--C 1.522 0.518 0 C-N-CA 126.215 1.864 . . . . 0.0 110.209 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.4 m -148.91 156.98 43.08 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.861 0.864 . . . . 0.0 108.805 179.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.5 tt -155.88 159.79 2.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 172.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 9.7 mt -134.93 157.04 40.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 166.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -133.13 155.97 48.29 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.122 2.569 . . . . 0.0 107.624 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -164.79 160.45 19.62 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.472 -1.393 . . . . 0.0 109.29 175.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.11 127.45 12.19 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 169.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.56 117.67 19.96 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 164.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -100.28 22.28 11.77 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.58 1.552 . . . . 0.0 109.703 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 86.58 121.09 1.3 Allowed Glycine 0 C--N 1.34 0.78 0 C-N-CA 125.324 1.44 . . . . 0.0 110.417 -177.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 50.82 1.01 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.656 2.382 . . . . 0.0 116.385 -171.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -151.5 145.27 25.06 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 126.028 1.731 . . . . 0.0 107.112 -162.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 68.0 t -138.4 108.63 4.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 125.119 1.368 . . . . 0.0 108.075 -175.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.5 mp -77.88 104.62 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 162.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 34.2 mt -76.98 135.15 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 106.212 -1.773 . . . . 0.0 106.212 165.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -126.74 103.07 7.34 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.628 1.571 . . . . 0.0 109.825 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -119.72 165.56 14.36 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.067 -1.646 . . . . 0.0 111.322 -174.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.6 t -156.9 169.97 23.56 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.588 1.555 . . . . 0.0 108.019 171.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 m -109.86 -9.05 14.81 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.19 1.396 . . . . 0.0 111.114 172.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -136.0 112.82 10.22 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.5 1.52 . . . . 0.0 108.586 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -48.44 -32.89 8.38 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 126.188 1.795 . . . . 0.0 112.583 175.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . 0.296 0.0 OUTLIER -79.29 3.77 17.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.132 1.901 . . . . 0.0 116.132 178.051 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.2 p -120.3 165.75 14.44 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 119.078 0.854 . . . . 0.0 111.168 -178.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -66.26 158.01 30.07 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.341 0.591 . . . . 0.0 110.247 -174.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 61.2 mt -91.38 142.7 27.4 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.475 0.71 . . . . 0.0 109.457 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.08 173.08 0.87 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.348 0.659 . . . . 0.0 109.533 164.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.62 112.66 9.09 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.549 1.14 . . . . 0.0 108.199 170.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.2 tptt -123.03 97.69 5.55 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 105.314 -2.106 . . . . 0.0 105.314 178.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.94 126.57 35.45 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 178.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -123.3 157.94 32.09 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.895 1.278 . . . . 0.0 108.179 174.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.3 158.87 33.24 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.346 -0.846 . . . . 0.0 110.145 162.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 17.2 mt -47.13 -54.49 10.41 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.168 0.987 . . . . 0.0 109.665 162.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.27 -30.84 70.71 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 117.138 -1.41 . . . . 0.0 112.116 -174.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -62.79 -57.83 9.55 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 120.073 1.306 . . . . 0.0 109.867 173.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 92.8 mt -55.64 -32.14 62.92 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.463 0.574 . . . . 0.0 111.376 -178.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.8 tttm -70.64 -47.03 62.11 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 118.677 -0.678 . . . . 0.0 111.635 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -50.83 71.83 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 119.155 0.889 . . . . 0.0 108.773 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -57.36 -62.38 1.81 Allowed 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 124.882 1.273 . . . . 0.0 109.025 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.431 ' C ' HE21 ' A' ' 123' ' ' GLN . 19.2 m-85 -127.99 13.38 6.77 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -157.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -143.77 58.03 1.36 Allowed 'General case' 0 C--O 1.24 0.586 0 O-C-N 119.792 -1.818 . . . . 0.0 109.901 173.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.624 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -108.47 -34.69 6.69 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.825 -168.39 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.2 t -107.55 148.05 29.75 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 125.297 1.439 . . . . 0.0 110.294 -173.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -60.82 -28.97 69.2 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.684 -1.26 . . . . 0.0 110.756 175.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.97 -39.22 74.18 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 119.589 1.086 . . . . 0.0 111.243 176.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.624 HE22 ' NE2' ' A' ' 119' ' ' GLN . 0.0 OUTLIER -61.95 -18.52 60.64 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 179.611 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -78.32 -2.46 38.2 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.659 178.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.87 -79.71 0.2 Allowed 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 153.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -52.11 -61.88 1.99 Allowed 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -160.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 76.0 t -55.8 -36.94 45.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 118.534 0.606 . . . . 0.0 110.559 -176.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -77.34 -30.22 53.85 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.999 1.32 . . . . 0.0 111.896 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.41 -49.76 74.2 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 126.009 1.724 . . . . 0.0 109.394 164.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -59.25 -38.77 80.88 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.769 0.713 . . . . 0.0 110.543 -176.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 90.1 t -64.3 -33.26 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 118.983 0.811 . . . . 0.0 111.08 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -86.38 -23.35 26.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 118.86 0.755 . . . . 0.0 112.53 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.88 -32.19 13.4 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 125.003 1.287 . . . . 0.0 111.825 -176.505 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.3 pp -56.5 125.5 22.35 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 166.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -79.73 167.37 20.72 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 9.9 m -134.43 6.64 3.55 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 120.353 -1.467 . . . . 0.0 111.398 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.921 0 C-N-CA 127.719 2.408 . . . . 0.0 104.774 163.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.924 0 N-CA-C 111.54 -0.624 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -78.42 -43.91 26.14 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 159.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 17.0 ptm -111.47 175.75 5.3 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 127.16 2.184 . . . . 0.0 109.208 166.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 78.4 mttt -139.08 -166.05 1.96 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.407 1.883 . . . . 0.0 108.135 176.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.456 ' CZ ' ' HE3' ' A' ' 114' ' ' LYS . 4.5 m-85 54.42 -172.8 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.045 1.338 . . . . 0.0 110.983 -173.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.3 p -138.53 150.26 46.19 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.787 2.035 . . . . 0.0 107.326 171.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -59.4 -41.72 90.1 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.423 0.556 . . . . 0.0 110.106 -174.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -44.44 -56.04 4.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.385 1.874 . . . . 0.0 111.433 169.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -69.43 -30.86 68.89 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.904 1.282 . . . . 0.0 112.605 -174.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 48.2 mt -80.2 -34.96 15.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 C-N-CA 123.22 0.608 . . . . 0.0 109.821 -179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.403 ' CA ' ' CZ ' ' A' ' 84' ' ' PHE . . . -55.73 -44.97 86.69 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 124.048 0.832 . . . . 0.0 112.055 -173.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.6 t -56.02 -50.49 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 118.306 1.053 . . . . 0.0 109.321 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 53.4 mt -58.26 -39.31 78.87 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.334 0.97 . . . . 0.0 110.832 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.13 -47.35 80.27 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 118.879 -0.581 . . . . 0.0 111.816 176.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.71 -29.27 72.73 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.976 0.807 . . . . 0.0 111.378 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.8 mt -62.08 -28.31 69.52 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 120.356 -1.673 . . . . 0.0 110.62 172.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.26 -12.99 59.95 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 117.111 -1.423 . . . . 0.0 113.094 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.0 mm -143.64 98.95 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 125.799 1.64 . . . . 0.0 107.309 -173.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t 56.71 68.65 2.06 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 124.836 1.254 . . . . 0.0 112.083 -175.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.32 -37.87 69.44 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.328 2.018 . . . . 0.0 110.711 176.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -47.01 77.74 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 118.185 -0.912 . . . . 0.0 112.078 -173.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 59.4 t90 -52.93 -52.94 56.13 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tt -58.15 -52.0 67.38 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 121.454 -0.779 . . . . 0.0 110.929 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -57.83 -35.17 70.51 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 118.574 -0.727 . . . . 0.0 111.123 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -69.66 -50.7 41.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 178.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -59.19 -38.41 79.76 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.354 -0.831 . . . . 0.0 112.305 -177.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 31.4 mm -60.53 -53.19 52.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 119.319 0.963 . . . . 0.0 109.36 173.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.65 -41.2 81.0 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 117.836 0.289 . . . . 0.0 110.749 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.53 -17.66 63.6 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.505 1.522 . . . . 0.0 113.141 176.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.1 t30 59.02 30.05 19.77 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.641 1.577 . . . . 0.0 110.838 -169.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -94.22 -16.65 23.46 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.879 1.272 . . . . 0.0 112.703 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.57 135.7 35.57 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.439 1.496 . . . . 0.0 109.59 -169.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 45.8 t -122.15 145.69 28.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 124.759 1.224 . . . . 0.0 108.004 170.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -106.31 136.22 46.42 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 128.049 2.54 . . . . 0.0 106.683 173.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -153.36 178.65 30.27 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-O 122.9 1.278 . . . . 0.0 113.697 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 26.8 mm -130.49 137.82 55.27 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.932 0 C-N-CA 127.981 2.512 . . . . 0.0 108.14 -171.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.484 HG22 ' H ' ' A' ' 68' ' ' TYR 0.255 2.8 m -70.59 -75.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.409 -2.503 0 CA-C-N 108.823 -3.808 . . . . 0.0 108.675 179.398 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.454 ' H ' HG21 ' A' ' 55' ' ' VAL . 13.7 mmtp 55.39 167.39 0.05 OUTLIER Pre-proline 0 C--N 1.349 0.543 0 C-N-CA 125.301 1.44 . . . . 0.0 111.573 -173.291 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -66.84 73.18 0.44 Allowed 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 121.719 1.613 . . . . 0.0 110.375 164.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.3 t -153.16 -63.67 0.15 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.826 1.25 . . . . 0.0 112.65 175.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.68 175.73 9.08 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 120.566 1.53 . . . . 0.0 110.935 -172.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 t -93.69 121.15 34.83 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 -179.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 4.8 m -150.42 160.8 32.28 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 123.957 0.903 . . . . 0.0 109.011 -176.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -71.5 158.92 52.79 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.937 1.758 . . . . 0.0 111.092 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.19 129.55 40.62 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 173.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.64 22.99 9.72 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 117.461 -1.744 . . . . 0.0 114.824 174.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.2 m -141.2 70.01 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.8 1.8 . . . . 0.0 110.1 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -85.3 -11.49 54.58 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.923 1.689 . . . . 0.0 114.61 -172.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -170.44 25.68 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 126.266 1.826 . . . . 0.0 109.506 -166.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.484 ' H ' HG22 ' A' ' 55' ' ' VAL . 3.5 m-85 -94.98 105.75 17.69 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.687 1.595 . . . . 0.0 107.426 176.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.08 150.11 4.66 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 118.99 0.813 . . . . 0.0 110.69 172.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -130.73 158.46 40.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.174 0.59 . . . . 0.0 111.03 -176.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -120.63 128.48 53.05 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 127.096 2.158 . . . . 0.0 106.98 174.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -153.22 159.62 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 173.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.78 161.45 16.02 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.371 0.605 . . . . 0.0 110.407 176.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.8 -5.59 4.5 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.106 0.962 . . . . 0.0 113.52 172.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -140.3 22.63 2.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.659 0.784 . . . . 0.0 110.972 -175.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -127.0 29.18 5.66 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.407 1.883 . . . . 0.0 109.407 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -63.61 -5.33 3.81 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 119.252 -2.155 . . . . 0.0 114.33 -177.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -143.19 22.49 1.88 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.093 1.357 . . . . 0.0 111.511 160.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.12 -71.83 1.31 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 125.634 1.587 . . . . 0.0 111.198 -176.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 21.4 m -145.29 160.78 40.99 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.206 1.802 . . . . 0.0 107.572 177.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tt -152.4 155.04 7.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 168.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 16.2 mt -130.76 140.52 48.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 166.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -114.83 146.82 40.64 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.326 1.85 . . . . 0.0 109.2 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . 0.403 ' CZ ' ' CA ' ' A' ' 29' ' ' GLY . 45.1 p90 -151.59 156.74 41.07 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.126 -0.984 . . . . 0.0 110.92 172.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.408 ' HB2' ' CD1' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -148.57 90.29 1.77 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.859 2.064 . . . . 0.0 110.248 178.836 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -72.36 104.42 3.74 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 119.287 -0.965 . . . . 0.0 109.006 172.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.14 128.83 55.34 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 125.666 1.586 . . . . 0.0 108.265 174.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 57.19 -89.23 0.01 OUTLIER Glycine 0 CA--C 1.528 0.875 0 C-N-CA 125.035 1.302 . . . . 0.0 111.735 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.6 mp0 -137.85 17.21 2.86 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.421 2.688 . . . . 0.0 112.024 -174.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 88.6 m -137.29 142.3 41.93 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.981 1.712 . . . . 0.0 110.154 -172.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.8 t -128.36 100.72 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 126.566 1.947 . . . . 0.0 107.04 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.3 mp -72.44 77.62 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 130.091 3.357 . . . . 0.0 109.198 165.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mt -65.14 129.85 29.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 173.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -128.47 121.3 28.61 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.533 1.133 . . . . 0.0 108.073 -176.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -145.21 169.54 18.01 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 121.122 -0.986 . . . . 0.0 110.72 -168.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.5 t -157.01 174.45 15.5 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.623 0.725 . . . . 0.0 111.29 -171.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.2 p -106.58 -8.99 16.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.615 1.166 . . . . 0.0 112.056 165.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -144.42 147.57 33.53 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.68 0.792 . . . . 0.0 111.827 -175.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.9 ttt-85 -81.57 10.94 5.13 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.582 1.153 . . . . 0.0 112.088 173.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -116.86 3.74 12.91 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.418 1.487 . . . . 0.0 114.039 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 34.4 p -130.27 176.1 8.39 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.75 0.82 . . . . 0.0 112.702 -166.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.73 148.56 44.55 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.027 1.331 . . . . 0.0 109.061 172.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 84.9 mt -86.42 142.12 28.65 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 126.434 1.894 . . . . 0.0 108.872 175.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -64.37 168.81 5.28 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.276 1.03 . . . . 0.0 109.841 167.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -129.43 103.72 7.07 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.274 1.43 . . . . 0.0 109.55 -179.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.1 tptt -122.29 92.16 3.66 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -82.01 120.25 25.02 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 171.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.12 145.49 45.91 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 126.737 2.015 . . . . 0.0 106.674 168.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 2.4 p -67.37 157.59 33.69 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 121.536 -0.727 . . . . 0.0 111.207 173.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.87 -46.04 64.33 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 121.823 -0.548 . . . . 0.0 110.493 166.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.26 -41.01 98.99 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 117.194 -1.384 . . . . 0.0 111.081 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -62.39 1.64 Allowed 'General case' 0 C--N 1.345 0.41 0 CA-C-N 119.402 1.001 . . . . 0.0 109.382 174.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 56.7 mt -60.97 -38.27 85.35 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -174.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.456 ' HE3' ' CZ ' ' A' ' 23' ' ' PHE . 1.9 ttmp? -62.99 -43.1 99.72 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 118.849 -0.596 . . . . 0.0 109.77 176.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -56.38 13.94 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.491 1.041 . . . . 0.0 108.354 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -51.69 -42.12 61.94 Favored 'General case' 0 C--O 1.23 0.075 0 C-N-CA 124.929 1.292 . . . . 0.0 111.899 -174.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -132.01 20.39 4.52 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.8 0.44 . . . . 0.0 112.135 -165.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -161.99 61.43 0.24 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 122.125 0.964 . . . . 0.0 111.082 176.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.63 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -103.27 -47.85 4.19 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.016 0.926 . . . . 0.0 111.697 179.611 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.463 ' H ' ' NE2' ' A' ' 123' ' ' GLN . 80.8 p -88.5 161.49 16.96 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 121.246 -0.909 . . . . 0.0 110.137 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -83.06 -32.2 26.94 Favored 'General case' 0 C--N 1.334 -0.104 0 O-C-N 121.807 -0.558 . . . . 0.0 110.599 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.88 -37.09 80.98 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.981 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.63 HE22 ' NE2' ' A' ' 119' ' ' GLN . 2.8 pt20 -65.92 -29.16 69.53 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.972 1.26 . . . . 0.0 111.793 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -56.38 -34.34 66.58 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 118.741 -0.647 . . . . 0.0 112.328 -172.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.56 -71.14 0.08 Allowed 'General case' 0 C--O 1.215 -0.739 0 C-N-CA 125.566 1.546 . . . . 0.0 108.155 174.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -47.9 -57.81 5.21 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 124.165 0.986 . . . . 0.0 112.585 178.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 92.3 t -55.95 -41.92 69.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.636 -174.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -77.76 -28.68 50.71 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.787 0.721 . . . . 0.0 112.091 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -58.91 -44.65 91.32 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 169.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -58.75 -28.48 65.92 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.225 0.61 . . . . 0.0 111.05 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.71 -14.22 18.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 123.609 0.764 . . . . 0.0 111.628 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -123.0 -12.36 7.98 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 120.174 1.352 . . . . 0.0 112.858 178.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -79.89 -21.08 66.59 Favored Glycine 0 CA--C 1.525 0.665 0 O-C-N 121.466 -0.771 . . . . 0.0 111.269 168.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.4 pp -68.52 141.04 55.65 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.369 1.085 . . . . 0.0 108.118 162.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -88.69 170.26 10.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 169.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 8.5 m -130.92 9.26 4.89 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.821 -1.175 . . . . 0.0 110.215 172.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 C--O 1.236 0.375 0 C-N-CA 128.24 2.616 . . . . 0.0 104.48 172.791 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.721 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -67.61 -17.86 64.77 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.277 1.031 . . . . 0.0 113.739 -177.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.16 63.19 2.37 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.677 1.191 . . . . 0.0 111.777 -171.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -123.27 166.91 14.47 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 127.494 2.318 . . . . 0.0 107.025 171.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -68.52 171.86 6.93 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 122.375 1.083 . . . . 0.0 109.255 165.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -137.17 155.97 48.91 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 126.929 2.092 . . . . 0.0 107.243 -170.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -49.68 -49.22 48.39 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.444 1.098 . . . . 0.0 110.722 175.218 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -44.82 -56.9 4.1 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.319 1.448 . . . . 0.0 112.332 172.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -70.92 -39.24 72.82 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.276 1.03 . . . . 0.0 110.602 -171.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 79.2 mt -64.86 -31.72 55.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.247 1.019 . . . . 0.0 109.237 175.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -49.44 -55.22 13.68 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 125.759 1.647 . . . . 0.0 111.843 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.0 t -68.31 -39.39 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 119.026 -0.512 . . . . 0.0 109.64 -173.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.9 mp -62.0 -52.74 62.78 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.908 0.776 . . . . 0.0 111.034 177.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.19 -31.43 72.57 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.574 0.625 . . . . 0.0 111.049 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.5 -27.24 70.56 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 118.637 0.653 . . . . 0.0 112.988 172.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.25 -27.45 60.77 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.977 1.889 . . . . 0.0 112.098 177.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.8 -25.92 64.93 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.891 170.305 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.1 mm -130.86 87.44 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 124.601 1.16 . . . . 0.0 108.68 -166.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.96 60.29 0.62 Allowed Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.009 1.324 . . . . 0.0 111.552 172.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -57.94 -37.52 95.79 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 123.236 2.624 . . . . 0.0 111.601 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -60.07 -41.66 92.89 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.376 0.67 . . . . 0.0 111.434 -178.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 37.1 t90 -61.16 -57.64 11.64 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 tt -50.25 -48.26 54.81 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.529 0.732 . . . . 0.0 110.337 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -63.95 -45.4 89.35 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.836 0.854 . . . . 0.0 111.376 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -59.89 -40.41 88.63 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.93 0.786 . . . . 0.0 111.208 173.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -63.68 -54.34 37.05 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -178.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 30.0 mm -55.49 -41.72 64.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.407 1.083 . . . . 0.0 109.691 178.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.84 7.21 1.64 Allowed 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.35 21.71 2.96 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.364 -0.835 . . . . 0.0 110.731 159.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.2 t30 50.95 25.0 2.02 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.373 2.269 . . . . 0.0 112.96 -175.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -81.24 -15.23 56.22 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 119.909 -1.744 . . . . 0.0 112.721 -174.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 tp -69.45 133.64 47.98 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 119.459 1.027 . . . . 0.0 109.044 -175.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.8 t -112.91 154.79 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 106.257 -1.757 . . . . 0.0 106.257 169.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -123.0 145.97 48.04 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 128.394 2.678 . . . . 0.0 107.209 173.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -162.86 171.13 38.58 Favored Glycine 0 C--N 1.332 0.348 0 O-C-N 121.166 -0.959 . . . . 0.0 113.687 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 31.4 mm -114.98 133.38 61.33 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.595 0 C-N-CA 126.804 2.042 . . . . 0.0 106.417 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -44.5 -54.21 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.589 1 C-N-CA 133.237 4.615 . . . . 0.0 112.266 169.271 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 19.8 mttt 62.89 159.65 0.12 Allowed Pre-proline 0 CA--C 1.536 0.421 0 C-N-CA 126.666 1.987 . . . . 0.0 112.971 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -70.75 -12.28 30.79 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.324 2.682 . . . . 0.0 113.278 -178.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 47.8 m -149.55 90.69 1.74 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.366 1.466 . . . . 0.0 107.795 170.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -138.92 -165.16 1.78 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 156.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.7 t -92.71 36.76 1.01 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.336 1.454 . . . . 0.0 112.585 -170.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.5 m -105.73 153.24 40.1 Favored Pre-proline 0 C--N 1.324 -0.539 0 C-N-CA 123.43 0.692 . . . . 0.0 109.252 -167.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.99 178.04 4.47 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.998 2.465 . . . . 0.0 111.311 -174.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.92 160.04 24.8 Favored 'General case' 0 C--O 1.238 0.482 0 O-C-N 121.185 -0.947 . . . . 0.0 109.35 170.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.9 33.74 65.81 Favored Glycine 0 CA--C 1.529 0.967 0 CA-C-O 119.615 -0.547 . . . . 0.0 112.117 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.2 m -146.34 25.38 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 125.923 1.689 . . . . 0.0 110.398 176.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.47 -5.14 0.3 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 127.778 2.431 . . . . 0.0 116.674 -164.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -157.57 15.98 0.25 Allowed 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 127.187 2.195 . . . . 0.0 109.883 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.484 ' CE2' ' HE3' ' A' ' 94' ' ' LYS . 5.6 m-85 -86.98 100.83 12.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.23 148.6 8.24 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.685 0.675 . . . . 0.0 110.076 174.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 46.6 p90 -123.38 166.78 14.76 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.422 1.089 . . . . 0.0 111.244 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 31.2 mt -136.27 130.46 33.03 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 127.564 2.346 . . . . 0.0 105.282 176.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.1 p -148.96 151.77 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 176.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -86.49 143.89 27.52 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.56 1.073 . . . . 0.0 109.003 176.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.19 -10.26 4.3 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 128.246 2.618 . . . . 0.0 114.604 -171.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.83 7.05 4.37 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.804 1.241 . . . . 0.0 111.609 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -134.58 31.82 3.37 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.188 1.795 . . . . 0.0 107.215 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -67.87 -18.69 64.89 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.449 1.5 . . . . 0.0 113.116 -166.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.75 20.66 12.24 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.59 1.956 . . . . 0.0 109.471 174.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.2 -98.36 2.56 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 126.535 2.017 . . . . 0.0 109.478 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.4 m -74.58 162.28 28.92 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.603 1.161 . . . . 0.0 108.57 169.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.9 tt -161.42 154.83 3.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 O-C-N 121.005 -1.059 . . . . 0.0 108.741 153.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.6 mt -138.34 147.77 25.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 175.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -133.39 156.66 47.26 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 127.894 2.477 . . . . 0.0 108.567 -174.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -162.7 159.61 24.54 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.408 -1.432 . . . . 0.0 111.174 174.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.52 115.88 6.2 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.94 1.296 . . . . 0.0 109.875 176.3 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.26 96.84 1.15 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.712 0.805 . . . . 0.0 109.482 167.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -64.18 -17.23 63.32 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.867 -0.587 . . . . 0.0 111.052 163.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 100.78 122.61 4.99 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 108.409 -1.876 . . . . 0.0 108.409 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 60.35 -7.14 0.08 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.067 1.747 . . . . 0.0 113.614 -161.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.07 146.29 36.96 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 128.148 2.579 . . . . 0.0 107.861 178.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 41.2 t -132.82 114.32 21.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 172.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 2.8 mp -79.71 105.25 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 N-CA-C 104.544 -2.391 . . . . 0.0 104.544 171.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 2.9 mt -77.32 142.09 14.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 106.359 -1.719 . . . . 0.0 106.359 169.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.484 ' HE3' ' CE2' ' A' ' 68' ' ' TYR . 88.6 mttt -132.13 123.52 27.28 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.904 1.281 . . . . 0.0 108.615 171.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 43.7 p90 -142.22 166.76 23.81 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.901 -1.124 . . . . 0.0 111.126 -176.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.4 t -154.19 175.83 13.0 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 124.523 1.129 . . . . 0.0 109.259 -172.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 93.2 p -119.78 3.84 11.06 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.273 1.029 . . . . 0.0 111.811 166.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -137.85 141.64 40.75 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 157.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -50.7 -42.47 57.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.56 1.144 . . . . 0.0 109.972 174.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -95.04 24.82 4.57 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 129.066 2.946 . . . . 0.0 113.454 -173.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 67.7 p -126.74 159.12 34.66 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.793 1.633 . . . . 0.0 109.359 170.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -64.87 130.26 42.79 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 121.372 -0.83 . . . . 0.0 110.019 -174.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.45 152.38 34.52 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.243 1.817 . . . . 0.0 110.815 177.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -73.75 174.88 7.79 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.919 1.688 . . . . 0.0 109.804 168.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -119.24 132.33 55.91 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.049 1.339 . . . . 0.0 109.145 168.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.01 130.41 17.71 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 167.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -140.53 92.16 2.49 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 119.829 1.195 . . . . 0.0 109.586 -167.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.05 166.45 11.23 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.045 0.938 . . . . 0.0 109.203 -174.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 42.0 p -84.93 161.99 19.61 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 123.088 0.555 . . . . 0.0 112.043 177.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.8 mt -57.78 -40.1 79.02 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 174.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.45 -37.0 82.3 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 116.238 -1.839 . . . . 0.0 111.554 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.28 -63.83 1.0 Allowed 'General case' 0 C--N 1.347 0.496 0 CA-C-N 121.64 2.018 . . . . 0.0 110.746 169.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 29.2 mt -55.84 -34.36 65.34 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.214 0.531 . . . . 0.0 110.893 -175.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -71.17 -40.4 71.31 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.148 0.579 . . . . 0.0 111.174 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.77 -14.64 61.58 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 124.646 1.178 . . . . 0.0 112.236 176.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -101.08 -41.76 6.64 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 123.456 0.703 . . . . 0.0 110.227 -173.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -130.98 -0.5 4.17 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -168.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -136.11 54.77 1.88 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 122.912 1.339 . . . . 0.0 110.617 -176.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -88.25 -59.04 2.35 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 127.561 2.344 . . . . 0.0 114.728 174.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.9 p -77.57 -166.96 0.84 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.882 1.673 . . . . 0.0 111.886 -164.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.24 -51.16 3.01 Favored 'General case' 0 CA--C 1.522 -0.103 0 C-N-CA 124.701 1.201 . . . . 0.0 108.604 -178.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.6 t -57.65 -30.44 65.41 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.262 1.825 . . . . 0.0 112.041 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -53.68 -32.4 51.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.668 1.576 . . . . 0.0 111.559 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -68.37 0.42 3.92 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 125.108 1.363 . . . . 0.0 112.361 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -108.78 0.19 20.28 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.566 1.546 . . . . 0.0 111.325 175.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -121.4 -64.7 1.2 Allowed 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 125.538 1.535 . . . . 0.0 107.478 173.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 21.9 t -52.23 -47.31 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.468 1.507 . . . . 0.0 111.056 -178.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -67.94 -32.31 72.66 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.35 0.871 . . . . 0.0 113.35 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -75.97 -35.02 59.81 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 126.672 1.989 . . . . 0.0 110.594 -172.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -60.89 -33.96 73.92 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 127.678 2.391 . . . . 0.0 111.172 171.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 52.7 t -66.37 -22.24 29.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 O-C-N 121.317 -0.865 . . . . 0.0 110.689 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -98.04 -12.26 22.08 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.611 1.164 . . . . 0.0 112.413 171.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.6 12.1 66.35 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 125.402 1.477 . . . . 0.0 112.414 178.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.9 pp -119.28 177.27 4.96 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.886 1.674 . . . . 0.0 109.405 174.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -130.65 176.03 8.52 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 127.029 2.132 . . . . 0.0 108.754 -168.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -133.69 -0.67 3.15 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.368 0.985 . . . . 0.0 113.087 -175.491 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.252 1.197 0 C-N-CA 127.763 2.425 . . . . 0.0 107.104 -155.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.009 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.3 p80 45.19 28.04 0.38 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 128.448 2.699 . . . . 0.0 116.425 173.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.95 174.28 15.57 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.553 2.341 . . . . 0.0 106.143 170.195 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt 50.99 28.99 4.15 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.772 2.029 . . . . 0.0 115.564 168.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 61.19 172.48 0.11 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 128.718 2.807 . . . . 0.0 111.148 -170.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.2 p -110.96 149.64 30.38 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 120.953 -1.092 . . . . 0.0 109.458 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -54.71 -31.02 57.55 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.381 1.472 . . . . 0.0 111.335 -176.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -59.87 -60.1 4.37 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 129.369 3.067 . . . . 0.0 110.742 174.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -69.59 -36.44 76.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.623 1.569 . . . . 0.0 109.473 -172.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 82.9 mt -62.34 -39.49 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.648 0.779 . . . . 0.0 109.131 170.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.21 -55.13 25.87 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 124.747 1.165 . . . . 0.0 111.879 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 50.5 t -61.44 -41.88 91.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.311 1.055 . . . . 0.0 110.51 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.1 mt -62.14 -49.27 76.53 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 118.818 0.735 . . . . 0.0 111.055 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.53 93.2 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.429 0.292 . . . . 0.0 110.967 175.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.85 -32.91 85.75 Favored Glycine 0 C--O 1.222 -0.654 0 CA-C-O 119.07 -0.85 . . . . 0.0 111.634 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 7.2 mp -65.57 -30.48 71.22 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 120.342 2.071 . . . . 0.0 112.496 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.16 -26.17 68.41 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 118.916 -0.564 . . . . 0.0 111.384 175.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 44.6 mm -131.18 99.93 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 C-N-CA 126.208 1.803 . . . . 0.0 106.854 -165.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.278 1.5 p 57.24 56.32 7.77 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.808 174.086 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -59.14 -38.33 87.15 Favored 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 123.82 3.014 . . . . 0.0 110.185 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -63.14 -46.08 88.92 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 123.997 0.919 . . . . 0.0 110.906 -176.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -57.19 -46.1 83.13 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 172.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.21 -50.35 70.63 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 106.463 -1.681 . . . . 0.0 106.463 -172.018 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HE2' ' CZ ' ' A' ' 130' ' ' TYR . 94.8 mttt -63.53 -40.33 96.76 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 125.372 1.469 . . . . 0.0 111.565 -178.23 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -57.06 -40.48 76.91 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.948 1.249 . . . . 0.0 110.603 175.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -81.03 -39.12 26.32 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 117.2 -1.381 . . . . 0.0 111.141 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 28.3 mm -57.45 -47.0 85.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 121.207 1.821 . . . . 0.0 108.73 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.69 -5.86 9.78 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -176.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.68 15.63 8.75 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.377 1.471 . . . . 0.0 112.495 173.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 66.44 6.7 4.5 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.043 1.737 . . . . 0.0 113.985 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.64 -13.67 56.07 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 120.446 -1.409 . . . . 0.0 112.235 -159.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.92 114.97 27.84 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.704 0.684 . . . . 0.0 110.728 -158.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 38.3 t -95.96 164.46 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 125.137 1.375 . . . . 0.0 108.601 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -143.49 138.28 29.11 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 128.977 2.911 . . . . 0.0 105.343 -176.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -157.68 177.58 34.4 Favored Glycine 0 C--N 1.333 0.407 0 CA-C-N 118.313 0.506 . . . . 0.0 112.346 173.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 15.7 mm -101.4 140.17 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.15 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 164.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.0 t -44.46 -64.54 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 C-N-CA 127.204 2.201 . . . . 0.0 111.469 176.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.4 mttt 57.57 165.53 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.065 1.746 . . . . 0.0 112.037 -170.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -76.69 -11.39 18.5 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 121.714 1.609 . . . . 0.0 112.832 176.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.3 m -97.12 23.93 6.85 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.423 1.489 . . . . 0.0 112.788 -163.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -139.94 -164.88 1.78 Allowed 'General case' 0 C--O 1.241 0.607 0 C-N-CA 127.176 2.191 . . . . 0.0 106.653 176.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 24.8 m -125.45 98.02 5.43 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 120.472 -1.392 . . . . 0.0 109.525 -166.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.2 m -137.57 157.73 73.21 Favored Pre-proline 0 C--O 1.241 0.645 0 C-N-CA 124.002 0.921 . . . . 0.0 113.054 -166.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.3 171.26 10.65 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.621 2.881 . . . . 0.0 110.602 171.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.32 158.19 34.43 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 121.594 -0.691 . . . . 0.0 111.735 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.49 31.32 63.26 Favored Glycine 0 CA--C 1.526 0.744 0 C-N-CA 124.009 0.814 . . . . 0.0 113.01 167.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.6 m -132.94 26.03 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 124.552 1.141 . . . . 0.0 110.317 174.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.97 -10.79 23.46 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 -154.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -151.39 31.76 0.59 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.863 2.065 . . . . 0.0 108.58 174.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -75.11 153.24 38.39 Favored 'General case' 0 C--O 1.232 0.151 0 O-C-N 120.919 -1.113 . . . . 0.0 108.49 173.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.2 m -72.83 154.48 40.6 Favored 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 123.712 0.805 . . . . 0.0 109.014 156.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -138.48 165.95 25.52 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.594 1.158 . . . . 0.0 109.823 167.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.3 mt -140.47 125.78 18.78 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 127.288 2.235 . . . . 0.0 105.504 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -148.23 150.94 13.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 174.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.66 159.26 17.21 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.784 0.802 . . . . 0.0 109.976 178.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.08 -18.03 63.94 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.199 1.0 . . . . 0.0 113.255 -168.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -102.97 -32.25 9.83 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 123.305 0.642 . . . . 0.0 111.536 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.97 9.65 0.52 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 129.038 2.935 . . . . 0.0 112.65 -176.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -56.41 -26.11 52.29 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.611 1.55 . . . . 0.0 113.618 -158.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.83 -5.88 19.43 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.695 1.589 . . . . 0.0 113.66 174.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.53 -93.64 0.88 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.852 1.215 . . . . 0.0 111.75 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.95 171.05 9.56 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.549 0.74 . . . . 0.0 110.133 -170.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tt -173.58 158.65 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 126.494 1.918 . . . . 0.0 106.944 162.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 22.8 mt -134.86 142.53 40.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 166.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -115.38 154.34 29.38 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.974 1.31 . . . . 0.0 108.541 174.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -158.65 148.1 19.19 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 125.349 1.459 . . . . 0.0 108.252 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -140.48 138.17 34.42 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 168.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -89.52 134.96 33.87 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 172.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -130.29 88.15 2.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 127.248 2.219 . . . . 0.0 108.658 174.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.69 -82.5 0.3 Allowed Glycine 0 C--N 1.336 0.541 0 C-N-CA 125.235 1.398 . . . . 0.0 113.078 170.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -123.79 9.93 8.91 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 126.815 2.046 . . . . 0.0 110.95 178.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.7 m -124.14 157.11 35.44 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.324 2.25 . . . . 0.0 108.51 -179.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 80.8 t -132.44 128.51 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.73 2.012 . . . . 0.0 105.882 168.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 20.1 mm -102.35 98.94 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 105.267 -2.123 . . . . 0.0 105.267 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.3 mt -83.44 130.67 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -134.53 91.26 2.76 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.879 1.672 . . . . 0.0 108.606 -175.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.0 p90 -108.48 170.36 8.07 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.807 -1.183 . . . . 0.0 111.645 -173.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.4 t -159.01 173.72 16.04 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.899 1.28 . . . . 0.0 110.152 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.9 m -121.7 12.9 10.72 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.08 2.552 . . . . 0.0 111.485 167.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -144.27 127.11 16.29 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 160.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -49.22 -39.34 29.52 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.593 0.757 . . . . 0.0 110.712 170.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -82.75 31.41 0.42 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.155 1.782 . . . . 0.0 113.628 -177.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 45.6 p -139.22 163.36 32.67 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 119.519 -1.988 . . . . 0.0 112.741 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.471 ' HA ' ' HE3' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -58.44 153.92 14.87 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.611 1.164 . . . . 0.0 110.028 169.387 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -105.54 156.17 18.48 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.259 1.424 . . . . 0.0 110.789 -169.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.17 179.04 1.66 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.834 1.254 . . . . 0.0 112.0 173.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -123.07 124.9 44.14 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.707 1.203 . . . . 0.0 109.413 168.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -144.76 105.95 4.2 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 103.911 -2.625 . . . . 0.0 103.911 168.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -118.05 109.34 16.33 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -172.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 27.0 mt -125.14 144.56 50.37 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -166.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 15.9 p -68.52 151.7 46.41 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.952 0.796 . . . . 0.0 109.834 172.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 26.8 mt -55.72 -36.0 66.75 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.426 -0.796 . . . . 0.0 111.211 168.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.4 t -61.53 -44.52 96.9 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.021 173.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.83 -60.81 2.85 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.411 1.085 . . . . 0.0 109.891 178.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 48.0 mt -55.91 -33.52 64.74 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 123.07 0.548 . . . . 0.0 111.948 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 -43.9 77.28 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.665 -0.647 . . . . 0.0 109.29 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -25.21 61.46 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.665 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.72 -66.61 0.61 Allowed 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 169.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -117.22 22.98 12.15 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.851 -1.156 . . . . 0.0 112.763 -158.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -151.06 26.55 0.71 Allowed 'General case' 0 C--O 1.239 0.542 0 O-C-N 120.744 -1.223 . . . . 0.0 112.632 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.627 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.6 OUTLIER -67.24 -59.62 3.27 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -172.514 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 17.9 p -77.81 172.03 14.07 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.016 1.327 . . . . 0.0 110.812 -171.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.83 -50.12 8.4 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 171.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -41.21 63.41 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.514 1.126 . . . . 0.0 110.92 -176.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.627 HE22 ' NE2' ' A' ' 119' ' ' GLN . 6.4 tt0 -48.17 -45.57 33.67 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.734 1.214 . . . . 0.0 111.497 178.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -59.34 -20.37 54.1 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.795 1.638 . . . . 0.0 113.49 -169.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -55.0 -70.7 0.1 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 170.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -57.57 -41.97 82.14 Favored 'General case' 0 C--O 1.222 -0.373 0 O-C-N 123.769 0.668 . . . . 0.0 111.467 -174.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 17.7 t -54.21 -59.0 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 O-C-N 123.919 0.762 . . . . 0.0 109.794 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -57.47 -34.04 68.61 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 123.169 0.293 . . . . 0.0 111.238 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -64.52 -42.15 95.95 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.961 1.304 . . . . 0.0 110.958 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . 0.408 ' CZ ' ' HE2' ' A' ' 42' ' ' LYS . 37.7 m-85 -58.78 -45.76 89.1 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.032 -1.043 . . . . 0.0 109.837 171.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 19.0 t -64.74 -31.1 52.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 O-C-N 121.844 -0.535 . . . . 0.0 110.89 179.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -84.84 -15.03 46.13 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.452 1.101 . . . . 0.0 113.181 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -96.94 -32.6 6.41 Favored Glycine 0 C--N 1.334 0.421 0 C-N-CA 124.123 0.868 . . . . 0.0 111.808 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.56 151.52 20.31 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.087 0.944 . . . . 0.0 112.177 -173.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 56.6 mtp85 -92.37 153.26 19.29 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 174.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 m -131.19 25.37 4.89 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.846 1.258 . . . . 0.0 109.635 173.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.917 2.887 . . . . 0.0 110.949 -164.141 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.642 0 CA-C-O 119.405 -0.664 . . . . 0.0 111.566 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -153.38 29.73 0.49 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.036 1.334 . . . . 0.0 111.286 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 3.1 ttt -101.74 66.45 1.06 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 167.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.8 pttp -140.93 37.1 1.77 Allowed 'General case' 0 N--CA 1.467 0.397 0 O-C-N 120.969 -1.082 . . . . 0.0 112.089 -172.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 55.76 -171.85 0.07 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.363 1.465 . . . . 0.0 110.433 -162.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -122.35 152.69 39.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.548 1.539 . . . . 0.0 109.534 -175.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.59 -55.62 5.03 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 125.707 1.603 . . . . 0.0 111.354 177.039 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -44.91 -63.21 0.97 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.651 1.58 . . . . 0.0 110.359 174.653 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 69.7 mm-40 -54.65 -59.64 4.43 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.108 0.963 . . . . 0.0 109.241 -176.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 35.8 mt -56.91 -34.63 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 125.438 1.495 . . . . 0.0 110.395 -170.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.56 -28.38 71.26 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 117.958 -1.468 . . . . 0.0 114.065 -178.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 72.4 t -71.95 -40.71 68.43 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.183 0 CA-C-N 119.027 1.414 . . . . 0.0 108.635 177.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.89 -43.8 97.83 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.218 0.607 . . . . 0.0 109.71 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.88 -43.58 95.61 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.081 -0.387 . . . . 0.0 110.931 174.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.39 -30.21 75.0 Favored Glycine 0 C--O 1.222 -0.604 0 N-CA-C 110.633 -0.987 . . . . 0.0 110.633 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.9 tp -69.33 -24.0 63.86 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 120.49 -1.594 . . . . 0.0 112.018 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.85 -21.46 62.42 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.849 -0.596 . . . . 0.0 111.793 170.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 28.7 mm -135.52 92.89 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 C-N-CA 126.261 1.824 . . . . 0.0 107.539 -158.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 74.7 m 60.2 54.91 4.05 Favored Pre-proline 0 CA--C 1.553 1.063 0 O-C-N 121.348 -0.845 . . . . 0.0 112.176 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -60.03 -38.15 79.88 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.968 3.112 . . . . 0.0 111.796 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -55.71 -52.65 63.15 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.699 1.199 . . . . 0.0 109.68 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -61.43 -38.26 86.52 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.684 1.194 . . . . 0.0 111.054 177.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -52.89 58.17 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -62.38 -43.16 99.48 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.866 0.866 . . . . 0.0 111.743 -175.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -61.25 -44.0 97.96 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 119.248 0.931 . . . . 0.0 110.045 -176.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -69.64 -35.89 75.6 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 117.289 -1.339 . . . . 0.0 112.422 -176.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.9 mm -56.5 -53.67 37.94 Favored 'Isoleucine or valine' 0 C--N 1.339 0.149 0 CA-C-N 119.215 0.916 . . . . 0.0 109.469 168.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.75 -21.7 66.06 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -177.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.95 -8.13 58.87 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 126.752 2.021 . . . . 0.0 113.663 169.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 44.89 43.55 7.15 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.238 2.215 . . . . 0.0 110.531 -169.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -103.53 -2.13 27.26 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.407 2.283 . . . . 0.0 115.06 -177.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.13 135.06 44.38 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.011 1.324 . . . . 0.0 110.664 -160.049 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 71.7 t -120.4 117.45 53.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 124.462 1.105 . . . . 0.0 108.041 -175.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -80.76 152.64 28.21 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.604 1.562 . . . . 0.0 108.357 163.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -173.79 165.32 37.11 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 171.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 36.1 mm -104.06 141.7 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 170.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 24.1 t -44.23 -71.66 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 127.322 2.249 . . . . 0.0 114.43 -171.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.1 mptt 55.77 165.8 0.06 OUTLIER Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 125.281 1.432 . . . . 0.0 113.777 -169.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.64 -4.39 14.52 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.11 2.54 . . . . 0.0 113.86 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.32 -70.37 0.1 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.127 2.171 . . . . 0.0 112.388 -174.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.5 171.39 13.43 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.124 0.97 . . . . 0.0 109.042 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -66.04 142.03 57.95 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 165.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -152.62 158.27 33.29 Favored Pre-proline 0 C--O 1.242 0.67 0 C-N-CA 123.658 0.783 . . . . 0.0 110.176 169.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.88 178.79 3.7 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 124.34 3.36 . . . . 0.0 111.197 166.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -76.2 167.78 21.24 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.346 -0.846 . . . . 0.0 111.391 178.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.44 18.72 77.18 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 118.603 -1.11 . . . . 0.0 114.402 165.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.2 m -130.24 21.88 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 118.764 1.282 . . . . 0.0 112.402 -174.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.74 -17.27 3.26 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 118.43 2.752 . . . . 0.0 118.43 -162.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -149.57 18.91 0.93 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 127.237 2.215 . . . . 0.0 109.195 -174.403 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.44 ' CD1' ' HG3' ' A' ' 85' ' ' LYS . 3.1 m-85 -69.7 148.86 48.69 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 171.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.0 t -67.23 161.56 24.59 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 155.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -141.99 141.92 32.91 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.814 161.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.1 133.75 52.88 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 172.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.7 p -156.79 149.96 10.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 174.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.25 170.32 15.8 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.709 1.14 . . . . 0.0 109.578 173.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.66 -29.98 63.89 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 122.134 0.968 . . . . 0.0 112.239 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -90.96 -37.61 13.38 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 127.51 2.324 . . . . 0.0 111.889 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . 0.279 0.0 OUTLIER -91.59 30.37 1.34 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.346 0.975 . . . . 0.0 111.859 -169.536 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -45.57 -53.98 8.27 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.51 1.124 . . . . 0.0 112.878 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -86.75 6.34 31.91 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.817 1.247 . . . . 0.0 112.537 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -92.17 -106.42 1.59 Allowed Glycine 0 CA--C 1.525 0.707 0 C-N-CA 126.68 2.086 . . . . 0.0 110.91 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 39.9 m -90.0 153.61 20.46 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.261 1.425 . . . . 0.0 108.893 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tt -153.62 146.25 14.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 O-C-N 120.14 -1.6 . . . . 0.0 108.777 162.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mt -128.39 113.05 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 178.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -90.77 143.43 26.73 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -148.6 160.18 43.36 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.983 -1.073 . . . . 0.0 111.612 170.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.44 ' HG3' ' CD1' ' A' ' 68' ' ' TYR . 1.3 tmtt? -148.91 129.37 13.9 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.073 0.949 . . . . 0.0 108.951 171.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -104.82 115.27 30.02 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 124.053 0.941 . . . . 0.0 110.09 -174.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -126.41 99.24 5.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.403 2.281 . . . . 0.0 108.512 -165.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 67.21 -83.13 0.13 Allowed Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.747 1.165 . . . . 0.0 114.821 173.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -133.78 20.82 3.86 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.242 2.217 . . . . 0.0 110.752 176.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.2 146.63 45.12 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.376 1.87 . . . . 0.0 109.022 -174.184 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 96.8 t -131.72 124.53 54.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 169.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 2.8 mp -93.04 101.47 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 105.094 -2.187 . . . . 0.0 105.094 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.5 mt -92.67 121.13 43.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -121.13 96.05 4.94 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 126.742 2.017 . . . . 0.0 107.4 -175.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 34.5 p90 -113.45 168.26 9.9 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.386 -1.446 . . . . 0.0 111.421 -174.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.1 t -155.44 179.39 9.22 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.844 1.658 . . . . 0.0 107.195 177.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.2 p -122.19 2.4 9.79 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 127.056 2.143 . . . . 0.0 110.019 171.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -139.84 131.76 27.7 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-O 121.117 0.484 . . . . 0.0 111.363 164.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -3.26 3.8 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 128.486 2.715 . . . . 0.0 112.994 177.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -122.59 33.06 5.54 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.546 1.538 . . . . 0.0 110.264 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.4 p -130.43 -164.43 1.42 Allowed 'General case' 0 CA--C 1.546 0.809 0 O-C-N 120.686 -1.259 . . . . 0.0 112.695 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -100.58 154.28 18.7 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.231 1.413 . . . . 0.0 108.481 169.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -89.46 158.2 17.81 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.845 0.858 . . . . 0.0 110.354 -172.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -67.36 -178.91 0.92 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.443 1.097 . . . . 0.0 109.154 160.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -140.68 97.82 3.28 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -97.08 160.89 14.08 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 155.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -156.13 91.03 1.24 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.624 1.17 . . . . 0.0 107.857 169.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -96.34 163.45 13.07 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.611 0.764 . . . . 0.0 109.562 -178.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 40.9 p -81.46 163.01 23.05 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 166.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.37 -43.15 78.92 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 123.637 0.775 . . . . 0.0 109.007 169.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.79 -39.71 95.08 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.369 -0.824 . . . . 0.0 111.583 -176.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.8 -65.74 0.51 Allowed 'General case' 0 C--N 1.345 0.41 0 CA-C-O 118.537 -0.744 . . . . 0.0 109.321 168.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 93.9 mt -54.73 -30.74 57.03 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.221 1.009 . . . . 0.0 112.304 -174.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 59.7 tttt -66.31 -46.74 75.88 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 -7.69 58.83 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 124.609 1.163 . . . . 0.0 113.097 178.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -73.01 -66.13 0.71 Allowed 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 160.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -130.06 11.48 5.54 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 120.537 -1.352 . . . . 0.0 113.918 -154.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' TYR . . . . . 0.475 ' CZ ' ' HE2' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -140.65 22.48 2.32 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 120.796 -1.19 . . . . 0.0 111.622 179.324 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLN . . . . . 0.627 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.4 OUTLIER -73.77 -45.55 51.04 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 105.097 -2.186 . . . . 0.0 105.097 -163.19 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.8 t -91.52 150.83 21.02 Favored 'General case' 0 C--N 1.352 0.674 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -74.51 -20.34 60.01 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-O 117.327 -1.32 . . . . 0.0 112.257 177.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 4.2 t -81.24 -32.4 33.38 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 120.212 1.369 . . . . 0.0 110.932 -178.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.627 HE22 ' NE2' ' A' ' 119' ' ' GLN . 7.8 pt20 -62.29 -26.77 68.59 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.981 1.264 . . . . 0.0 111.405 -176.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.475 ' HE2' ' CZ ' ' A' ' 118' ' ' TYR . 2.6 mtpm? -47.87 -29.61 3.42 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 125.986 1.714 . . . . 0.0 113.463 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -52.67 -59.38 4.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.482 1.513 . . . . 0.0 110.26 175.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.73 -49.89 66.79 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 125.478 1.511 . . . . 0.0 110.013 -177.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 13.6 t -54.4 -54.85 18.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.405 -178.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -65.07 -25.62 67.88 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 178.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -65.41 -34.75 79.04 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.704 172.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -66.08 -34.82 78.94 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 119.963 1.256 . . . . 0.0 111.098 173.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 18.2 t -73.41 -12.01 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 O-C-N 121.558 -0.714 . . . . 0.0 111.136 177.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -121.34 22.14 10.88 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.491 1.517 . . . . 0.0 111.951 -176.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -132.86 -0.13 4.39 Favored Glycine 0 CA--C 1.528 0.9 0 O-C-N 120.876 -1.14 . . . . 0.0 112.684 174.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -76.26 -178.09 4.35 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 125.913 1.685 . . . . 0.0 111.632 173.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.1 mtt-85 -130.62 166.43 20.69 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 126.33 1.852 . . . . 0.0 107.013 164.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.3 m -122.73 -0.51 9.1 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 124.295 1.038 . . . . 0.0 111.013 177.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 C--O 1.246 0.884 0 CA-C-O 115.198 -2.334 . . . . 0.0 107.595 -149.151 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 . . . . . 0 CA--C 1.543 0.684 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 p -131.22 152.39 50.55 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.182 1.393 . . . . 0.0 107.29 168.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -59.33 -42.89 92.53 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 124.357 1.063 . . . . 0.0 109.769 -173.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -45.12 -47.64 12.12 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.019 1.728 . . . . 0.0 111.998 172.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -73.84 -28.71 61.74 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.685 1.194 . . . . 0.0 111.846 -174.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 71.4 mt -83.15 -34.12 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 125.018 1.327 . . . . 0.0 110.11 -176.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.59 -36.78 93.7 Favored Glycine 0 C--N 1.336 0.538 0 CA-C-N 118.997 0.817 . . . . 0.0 112.157 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.7 t -56.81 -47.8 82.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 CA-C-N 117.474 0.637 . . . . 0.0 109.972 175.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 mp -60.02 -46.77 88.39 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.688 0.676 . . . . 0.0 109.27 177.253 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.7 -25.5 68.23 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.89 -24.31 10.77 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 119.059 0.845 . . . . 0.0 112.225 176.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mp -62.68 -28.14 69.73 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.067 1.933 . . . . 0.0 110.391 165.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.59 -24.0 61.03 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.094 1.358 . . . . 0.0 113.289 172.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.7 mm -142.38 93.12 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 125.255 1.422 . . . . 0.0 107.428 -166.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.83 65.49 1.0 Allowed Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 125.783 1.633 . . . . 0.0 111.282 -176.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -60.98 -33.28 92.54 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.3 2.667 . . . . 0.0 111.643 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -71.25 -40.86 70.75 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.582 0.753 . . . . 0.0 109.343 -176.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.401 ' HA ' ' HG2' ' A' ' 43' ' ' GLN . 44.7 t90 -64.54 -37.52 87.84 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 121.985 -0.447 . . . . 0.0 111.22 173.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.78 -49.86 76.06 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 120.998 -1.064 . . . . 0.0 108.682 173.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -59.62 -48.04 83.22 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 116.879 -1.534 . . . . 0.0 113.161 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.401 ' HG2' ' HA ' ' A' ' 40' ' ' TRP . 0.0 OUTLIER -57.63 -38.95 75.86 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.167 1.349 . . . . 0.0 111.157 -176.052 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -75.64 -48.5 21.87 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.65 1.18 . . . . 0.0 110.732 -176.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.3 mm -59.62 -32.03 48.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 119.419 1.009 . . . . 0.0 111.151 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.7 -39.04 70.48 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.458 1.026 . . . . 0.0 111.329 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -110.11 19.81 18.56 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.851 1.26 . . . . 0.0 111.758 176.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.78 14.54 3.27 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 120.247 -1.533 . . . . 0.0 113.808 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -69.94 -6.61 34.22 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.529 1.932 . . . . 0.0 113.422 -171.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.3 tp -86.01 131.01 34.37 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.086 1.354 . . . . 0.0 108.275 -172.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 98.8 t -106.44 131.07 57.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 171.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -94.09 116.36 28.77 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 161.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -144.3 164.06 27.7 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 171.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 22.8 mm -101.62 140.99 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -177.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.549 HG13 HG11 ' A' ' 61' ' ' VAL . 31.1 t -51.7 -73.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 125.876 1.67 . . . . 0.0 110.927 175.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? 56.62 166.01 0.06 OUTLIER Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 125.728 1.611 . . . . 0.0 112.84 -168.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -70.34 75.85 1.42 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 121.746 1.631 . . . . 0.0 109.061 160.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.1 t -130.51 -56.02 1.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.053 1.341 . . . . 0.0 110.986 -167.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -130.46 176.14 8.39 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.194 0.998 . . . . 0.0 108.625 -171.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.5 m -57.92 113.95 2.11 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.594 0.758 . . . . 0.0 109.814 171.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.549 HG11 HG13 ' A' ' 55' ' ' VAL . 6.1 m -137.98 159.34 68.89 Favored Pre-proline 0 C--O 1.239 0.521 0 O-C-N 121.965 -0.459 . . . . 0.0 110.236 174.264 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -72.26 175.64 9.68 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 123.578 2.852 . . . . 0.0 111.475 169.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.26 152.19 43.53 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 123.867 0.867 . . . . 0.0 111.34 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.65 28.93 33.87 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.856 -0.969 . . . . 0.0 114.483 162.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.0 m -140.52 28.68 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 124.405 1.082 . . . . 0.0 111.203 -174.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -64.0 -16.16 60.99 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 -153.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -151.51 29.14 0.62 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 127.609 2.363 . . . . 0.0 108.496 173.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -71.46 148.31 46.97 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 172.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.432 ' HB2' ' CE1' ' A' ' 84' ' ' PHE . 0.0 OUTLIER -77.97 142.49 38.29 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 166.01 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -128.06 135.31 49.66 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.874 0.87 . . . . 0.0 109.412 170.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.23 131.39 46.2 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 172.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.422 ' HB ' HG13 ' A' ' 81' ' ' ILE . 7.5 p -151.39 166.66 1.95 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 172.463 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.4 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -95.01 156.26 16.39 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 165.477 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.41 -16.14 53.21 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -113.21 -2.01 14.2 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.77 1.228 . . . . 0.0 111.978 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.4 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 31.6 m-20 -110.43 22.77 15.09 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.373 1.069 . . . . 0.0 110.08 -170.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -44.88 -63.95 0.81 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.267 1.027 . . . . 0.0 111.154 -174.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -82.75 -16.65 47.16 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.796 0.438 . . . . 0.0 110.196 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -54.76 -80.22 0.08 OUTLIER Glycine 0 CA--C 1.527 0.81 0 C-N-CA 127.994 2.711 . . . . 0.0 113.82 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -148.45 148.78 30.66 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.208 1.004 . . . . 0.0 108.683 -176.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.422 HG13 ' HB ' ' A' ' 72' ' ' VAL . 3.7 tt -150.67 148.49 15.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-N 119.175 0.898 . . . . 0.0 109.225 -177.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 50.1 mt -134.85 110.01 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 N-CA-C 107.823 -1.176 . . . . 0.0 107.823 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -85.83 146.62 26.67 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 169.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.432 ' CE1' ' HB2' ' A' ' 69' ' ' SER . 26.3 p90 -149.59 164.47 35.03 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.626 -1.296 . . . . 0.0 110.152 167.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.65 124.31 4.94 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 167.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.84 124.89 28.68 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 161.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -123.21 115.51 21.87 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 166.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 70.24 -96.77 0.56 Allowed Glycine 0 CA--C 1.523 0.575 0 C-N-CA 124.102 0.858 . . . . 0.0 112.817 175.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -136.29 21.31 3.19 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.572 1.949 . . . . 0.0 110.364 -177.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.0 m -125.97 149.28 48.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.63 1.572 . . . . 0.0 107.368 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 60.0 t -122.41 130.54 74.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.376 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 166.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.444 ' N ' HD12 ' A' ' 92' ' ' ILE . 1.1 mp -106.66 92.82 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 176.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.6 mt -77.87 129.91 36.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -131.06 98.12 4.49 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 125.535 1.534 . . . . 0.0 107.089 -174.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -124.15 164.65 19.04 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.613 -1.305 . . . . 0.0 110.461 -168.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.1 t -156.49 160.51 39.61 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.121 0.568 . . . . 0.0 109.64 174.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.9 p -108.7 8.2 26.78 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.17 1.788 . . . . 0.0 110.987 171.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -152.63 101.97 2.68 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 127.148 2.179 . . . . 0.0 106.711 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 tpt180 -44.26 -50.61 8.84 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 130.92 3.688 . . . . 0.0 110.594 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -75.35 3.5 8.94 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.0 p -119.85 165.52 14.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.849 0.356 . . . . 0.0 110.903 171.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' A' ' 103' ' ' LEU . 10.5 ptmt -65.49 173.28 2.77 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 122.669 1.223 . . . . 0.0 111.379 -177.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.412 ' O ' ' HE2' ' A' ' 102' ' ' LYS . 2.9 mm? -82.3 153.49 25.8 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.84 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.68 -179.7 1.86 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.855 0.862 . . . . 0.0 109.024 156.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -138.61 120.0 14.86 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.559 1.144 . . . . 0.0 108.211 169.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 mttm -112.08 106.27 14.86 Favored 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 158.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -84.06 135.48 34.4 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 160.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -134.48 158.17 44.62 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.774 1.63 . . . . 0.0 106.763 169.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.9 p -69.42 155.13 40.95 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.634 161.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.0 mt -58.4 -30.54 66.92 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.703 -0.623 . . . . 0.0 111.313 169.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.0 t -64.76 -44.05 91.33 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 117.323 -1.322 . . . . 0.0 111.447 173.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -57.08 10.37 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 120.053 1.297 . . . . 0.0 109.561 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 16.0 mt -58.49 -44.85 89.54 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.314 1.445 . . . . 0.0 111.156 -179.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -61.22 -38.69 87.51 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.529 -0.732 . . . . 0.0 110.944 177.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -81.74 -19.25 41.79 Favored 'General case' 0 C--O 1.223 -0.329 0 O-C-N 120.463 -1.398 . . . . 0.0 111.127 -175.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -79.03 -50.64 10.76 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.544 1.138 . . . . 0.0 111.328 171.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -123.03 18.1 10.04 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 121.16 -0.962 . . . . 0.0 112.608 -165.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.463 ' CZ ' ' HE2' ' A' ' 124' ' ' LYS . 2.9 t80 -148.39 30.99 0.83 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 120.535 -1.353 . . . . 0.0 110.066 175.09 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.97 -65.2 0.71 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 -176.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.5 p -75.89 175.77 8.46 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.617 0.767 . . . . 0.0 111.285 -169.223 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -42.38 11.98 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 121.116 -0.99 . . . . 0.0 110.235 173.446 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.2 m -57.77 -39.84 78.4 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-N 118.923 0.783 . . . . 0.0 111.374 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -58.65 -25.54 62.87 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.225 1.01 . . . . 0.0 111.976 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.463 ' HE2' ' CZ ' ' A' ' 118' ' ' TYR . 7.7 mtpt -63.47 -21.26 66.21 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.532 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -65.35 -64.3 0.89 Allowed 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 167.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -48.74 76.38 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 123.405 0.682 . . . . 0.0 112.254 -168.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.12 -54.04 31.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -66.13 -18.25 65.23 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -75.25 -44.08 48.01 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 125.461 1.504 . . . . 0.0 109.735 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -59.67 -32.02 70.1 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.848 0.859 . . . . 0.0 110.07 171.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 38.8 t -69.96 -20.53 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 O-C-N 120.654 -1.279 . . . . 0.0 111.977 172.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -118.39 20.98 12.88 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.92 1.288 . . . . 0.0 111.438 -173.059 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -134.75 18.41 4.08 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 127.315 2.388 . . . . 0.0 110.857 169.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -90.55 164.95 14.03 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 123.976 0.911 . . . . 0.0 110.151 169.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.47 165.36 11.08 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.719 1.608 . . . . 0.0 107.157 162.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -136.15 -4.96 2.12 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 124.519 1.127 . . . . 0.0 111.776 -167.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 . . . . . 0 C--O 1.247 0.931 0 C-N-CA 131.246 3.818 . . . . 0.0 102.638 -172.585 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 . . . . . 0 N--CA 1.451 -0.408 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 p -121.09 162.62 19.72 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 161.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -62.7 -35.13 78.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.561 0.696 . . . . 0.0 110.3 -165.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -43.3 95.27 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.486 1.115 . . . . 0.0 110.59 177.246 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -58.68 -47.52 84.22 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.836 0.854 . . . . 0.0 108.748 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 88.0 mt -65.07 -41.9 93.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 123.722 0.809 . . . . 0.0 109.371 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.65 -43.75 91.31 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 123.657 0.646 . . . . 0.0 112.667 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.9 t -60.76 -51.62 71.07 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 C-N-CA 123.493 0.717 . . . . 0.0 109.34 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.3 -33.39 75.4 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.532 1.06 . . . . 0.0 111.76 -175.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.1 95.23 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 122.835 0.454 . . . . 0.0 110.033 173.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.84 7.09 44.4 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-O 118.445 -1.197 . . . . 0.0 113.091 173.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -100.8 -8.9 22.23 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 119.788 1.794 . . . . 0.0 111.753 162.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -98.99 -10.03 23.21 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.157 0.983 . . . . 0.0 113.414 173.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.479 HD12 ' CE2' ' A' ' 95' ' ' TYR . 40.5 mm -139.73 93.61 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 129.684 3.194 . . . . 0.0 107.484 -172.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 63.01 73.42 0.51 Allowed Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -78.86 -30.31 2.94 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.439 2.093 . . . . 0.0 111.588 -171.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.51 -44.22 91.6 Favored 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 125.391 1.476 . . . . 0.0 109.743 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.409 ' CZ3' HD12 ' A' ' 82' ' ' ILE . 63.9 t90 -52.37 -62.54 1.58 Allowed 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 125.172 1.389 . . . . 0.0 110.093 168.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.0 tt -52.16 -51.94 54.9 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 118.704 0.684 . . . . 0.0 111.471 -175.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.1 mttm -59.25 -44.92 92.36 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.343 -0.837 . . . . 0.0 111.413 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -60.98 -45.48 94.61 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.633 1.106 . . . . 0.0 110.631 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -58.26 -42.88 87.4 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 29.6 mm -64.78 -46.11 93.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 118.741 0.7 . . . . 0.0 110.178 176.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.36 -20.27 53.41 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.618 1.099 . . . . 0.0 112.311 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -102.16 1.14 35.73 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.623 1.569 . . . . 0.0 112.623 174.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 44.95 33.96 1.14 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.497 2.319 . . . . 0.0 111.14 -170.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -88.97 -18.08 28.16 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.802 2.041 . . . . 0.0 112.976 -173.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.88 130.5 37.67 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.484 1.514 . . . . 0.0 109.458 -163.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 55.6 t -108.52 156.9 8.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-O 122.955 1.359 . . . . 0.0 108.215 172.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -126.96 138.37 53.26 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.516 2.326 . . . . 0.0 105.249 176.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -161.62 -178.84 35.89 Favored Glycine 0 N--CA 1.445 -0.724 0 CA-C-O 122.241 0.912 . . . . 0.0 112.428 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.4 mm -124.48 134.85 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 C-N-CA 129.161 2.984 . . . . 0.0 104.73 -173.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.487 HG13 HG21 ' A' ' 61' ' ' VAL . 21.3 t -44.73 -53.96 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 C-N-CA 124.104 0.962 . . . . 0.0 113.287 -176.299 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.9 mmtt 65.16 156.31 0.12 Allowed Pre-proline 0 CA--C 1.532 0.257 0 C-N-CA 129.213 3.005 . . . . 0.0 111.09 -171.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.96 -3.11 7.74 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 124.103 3.202 . . . . 0.0 113.897 -176.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -120.02 -2.41 10.25 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.796 -1.19 . . . . 0.0 113.904 -162.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -89.58 173.01 8.55 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 120.814 1.643 . . . . 0.0 113.471 -170.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.6 t -76.33 35.75 0.15 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 129.51 3.124 . . . . 0.0 112.682 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.487 HG21 HG13 ' A' ' 55' ' ' VAL . 2.5 m -90.33 151.87 45.0 Favored Pre-proline 0 CA--C 1.536 0.441 0 O-C-N 120.675 -1.266 . . . . 0.0 113.502 -163.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.0 158.11 56.21 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.398 2.732 . . . . 0.0 110.278 176.125 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.93 144.27 56.33 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 123.393 0.677 . . . . 0.0 109.479 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.85 20.89 45.04 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-N 119.164 0.893 . . . . 0.0 113.429 176.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.4 m -140.29 90.81 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 104.308 -2.479 . . . . 0.0 104.308 166.078 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -92.42 -15.89 26.61 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -169.7 46.37 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.999 1.72 . . . . 0.0 110.956 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.401 ' O ' HG23 ' A' ' 55' ' ' VAL . 4.9 m-85 -94.9 114.96 26.87 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 162.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.83 154.41 7.18 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.439 1.018 . . . . 0.0 110.424 173.067 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 38.7 p90 -130.78 153.74 48.74 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.326 0.651 . . . . 0.0 110.447 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -119.1 134.45 55.19 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 126.767 2.027 . . . . 0.0 106.573 170.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.6 p -147.89 158.42 8.38 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 N-CA-C 104.722 -2.325 . . . . 0.0 104.722 171.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.75 164.6 17.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.931 1.241 . . . . 0.0 107.905 168.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.63 0.4 26.6 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 121.354 -0.841 . . . . 0.0 112.807 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -137.87 4.03 2.51 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.492 1.042 . . . . 0.0 112.678 -168.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -128.31 34.0 4.62 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.483 1.913 . . . . 0.0 109.569 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -56.79 -13.38 2.51 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -163.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.42 7.06 7.67 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 121.064 1.756 . . . . 0.0 111.893 174.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -82.38 -71.28 1.31 Allowed Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 126.494 1.997 . . . . 0.0 110.065 -178.177 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.8 m -118.79 171.13 8.43 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 117.981 0.891 . . . . 0.0 109.462 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.0 tt -168.32 148.52 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.521 0 C-N-CA 126.958 2.103 . . . . 0.0 106.945 158.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.409 HD12 ' CZ3' ' A' ' 40' ' ' TRP . 73.5 mt -132.58 131.2 60.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.106 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 173.137 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -105.52 151.5 24.22 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 125.583 1.553 . . . . 0.0 108.69 172.294 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -144.08 156.93 44.56 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.678 1.191 . . . . 0.0 108.783 170.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.401 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 18.0 tttt -144.91 134.53 23.36 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 161.172 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.41 123.22 21.24 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 159.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -99.09 23.16 9.38 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.013 0.925 . . . . 0.0 109.037 165.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 76.8 115.08 0.14 Allowed Glycine 0 C--N 1.34 0.772 0 C-N-CA 125.963 1.744 . . . . 0.0 110.821 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 61.54 0.77 0.5 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.718 1.607 . . . . 0.0 113.645 -173.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.41 149.78 38.13 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.556 2.342 . . . . 0.0 106.628 177.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.78 129.57 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 172.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 19.4 mm -100.09 112.96 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 174.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.5 mt -101.43 118.07 47.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.467 ' HB3' HD13 ' A' ' 103' ' ' LEU . 72.9 mttt -116.72 104.99 11.91 Favored 'General case' 0 C--O 1.223 -0.306 0 C-N-CA 126.936 2.094 . . . . 0.0 107.17 -172.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.479 ' CE2' HD12 ' A' ' 36' ' ' ILE . 40.1 p90 -125.79 169.71 12.33 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.164 -1.585 . . . . 0.0 110.761 -177.309 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.1 t -151.26 168.7 23.94 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.149 1.38 . . . . 0.0 108.317 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.9 p -88.65 -12.73 41.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.664 1.185 . . . . 0.0 113.178 167.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -150.1 137.36 19.64 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.55 0.74 . . . . 0.0 109.771 -174.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -60.14 -21.03 61.11 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.577 1.551 . . . . 0.0 112.04 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -94.47 2.4 55.73 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.6 p -121.88 156.35 33.5 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.352 0.978 . . . . 0.0 112.771 -172.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.2 tmtt? -64.4 135.62 56.3 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 124.63 1.172 . . . . 0.0 109.819 -169.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.467 HD13 ' HB3' ' A' ' 94' ' ' LYS . 83.4 mt -72.81 143.9 47.71 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 123.984 0.914 . . . . 0.0 109.763 -176.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -71.24 -171.69 0.62 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.226 1.41 . . . . 0.0 109.439 171.04 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.93 103.91 4.09 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.114 -0.991 . . . . 0.0 110.172 170.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -85.3 147.53 26.5 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 106.147 -1.797 . . . . 0.0 106.147 147.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -137.5 127.31 25.53 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 168.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.4 mt -141.67 139.26 32.94 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -168.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 16.9 p -69.28 154.64 41.71 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.319 0.963 . . . . 0.0 109.873 173.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 20.4 mt -59.45 -28.54 67.08 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.314 -0.866 . . . . 0.0 110.046 168.058 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.46 -29.94 65.44 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.81 -0.556 . . . . 0.0 112.329 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.11 -59.84 2.66 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 105.856 -1.905 . . . . 0.0 105.856 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.61 -37.08 72.67 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.76 1.224 . . . . 0.0 113.138 -175.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -70.57 -31.75 68.89 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.49 -0.756 . . . . 0.0 110.21 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.401 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -67.78 -63.02 1.14 Allowed 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 174.743 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -46.88 -53.55 11.89 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.315 1.446 . . . . 0.0 111.59 -173.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -119.14 11.46 12.38 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 121.827 -0.546 . . . . 0.0 111.953 -163.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -149.44 34.85 0.71 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -81.08 -40.33 24.29 Favored 'General case' 0 C--N 1.342 0.278 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 16.6 p -89.02 -178.84 5.79 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.899 1.681 . . . . 0.0 110.543 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 -88.45 -45.41 9.98 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 120.994 -1.066 . . . . 0.0 109.314 170.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 37.3 p -66.63 -30.27 70.51 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.301 0.955 . . . . 0.0 111.213 -175.113 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -58.43 -30.96 67.31 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.256 0.934 . . . . 0.0 110.618 176.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -59.76 -27.22 66.34 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 121.612 -0.68 . . . . 0.0 111.78 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.18 -50.23 61.76 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.045 1.338 . . . . 0.0 108.853 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.85 -48.68 75.78 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.679 0.752 . . . . 0.0 111.815 176.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 54.8 t -53.98 -54.48 20.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.382 -177.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -63.79 -24.99 67.98 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 177.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -64.08 -43.66 94.73 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.852 0.751 . . . . 0.0 110.244 171.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -60.05 -37.07 78.75 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.619 1.099 . . . . 0.0 110.418 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 22.0 t -71.05 -8.85 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 123.626 0.77 . . . . 0.0 111.61 178.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -117.57 -14.53 10.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.741 1.216 . . . . 0.0 113.376 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -97.86 -5.37 57.54 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 125.793 1.663 . . . . 0.0 112.716 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -68.32 170.95 7.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 122.205 1.002 . . . . 0.0 110.352 165.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -127.49 174.43 9.03 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 126.927 2.091 . . . . 0.0 107.357 172.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.9 m -149.0 16.97 0.96 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.674 1.125 . . . . 0.0 112.722 -171.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 C--O 1.252 1.222 0 C-N-CA 125.732 1.613 . . . . 0.0 108.918 -171.243 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 12.0 m-30 . . . . . 0 CA--C 1.544 0.749 0 CA-C-O 121.178 0.513 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -138.66 150.73 46.53 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 129.313 3.045 . . . . 0.0 107.972 177.792 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -51.07 -40.95 59.53 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.978 0.911 . . . . 0.0 110.188 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -53.19 -59.47 4.52 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.459 1.503 . . . . 0.0 112.52 174.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -63.46 -26.16 68.6 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.608 1.563 . . . . 0.0 111.407 -175.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 93.1 mt -78.55 -40.62 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 C-N-CA 125.184 1.394 . . . . 0.0 109.742 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.7 -40.66 89.03 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 124.679 1.133 . . . . 0.0 112.431 -175.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.8 t -66.29 -49.37 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.3 mp -54.05 -49.6 68.64 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.202 0.91 . . . . 0.0 110.68 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.6 -38.01 86.04 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.1 0.56 . . . . 0.0 111.248 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.88 -32.58 73.82 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 111.81 -0.516 . . . . 0.0 111.81 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.0 mt -64.94 -23.32 67.19 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 120.468 -1.607 . . . . 0.0 111.671 176.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.457 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -79.98 -17.59 52.51 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.358 -0.839 . . . . 0.0 112.96 171.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.529 HD11 ' HE2' ' A' ' 106' ' ' LYS . 2.9 mp -134.52 97.73 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 125.797 1.639 . . . . 0.0 107.428 -172.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.92 54.96 1.25 Allowed Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.02 0.928 . . . . 0.0 110.605 175.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -56.05 -39.57 90.39 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 123.262 2.641 . . . . 0.0 111.246 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -67.34 -34.4 77.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.803 1.241 . . . . 0.0 112.527 -175.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 34.9 t90 -63.68 -54.33 37.22 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 173.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 tt -50.96 -48.4 61.01 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.158 0.583 . . . . 0.0 110.748 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -59.32 -47.42 85.48 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.904 0.882 . . . . 0.0 111.306 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -58.58 -40.21 82.51 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 120.779 1.627 . . . . 0.0 112.346 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -67.01 -45.02 78.85 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.991 0.9 . . . . 0.0 109.205 -177.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.592 HD11 HD22 ' A' ' 50' ' ' LEU . 96.1 mt -71.8 -32.32 44.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 O-C-N 121.422 -0.799 . . . . 0.0 109.52 -178.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.83 -4.17 33.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.88 0.872 . . . . 0.0 112.581 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.0 -16.24 26.79 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.134 0.879 . . . . 0.0 111.673 160.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 68.83 30.26 4.81 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 127.829 2.452 . . . . 0.0 109.287 -170.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -94.96 -89.15 0.24 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 119.023 -0.513 . . . . 0.0 109.66 178.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.723 HD23 ' HB3' ' A' ' 134' ' ' LEU 0.314 13.0 tp 40.9 97.28 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 129.592 3.157 . . . . 0.0 113.921 175.41 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.9 t -96.14 143.51 12.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 120.096 1.316 . . . . 0.0 109.003 -177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -119.65 137.35 53.94 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 128.139 2.576 . . . . 0.0 107.831 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.15 174.77 32.56 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 176.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.6 mm -116.99 146.2 21.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 172.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.5 t -49.91 -77.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 126.299 1.84 . . . . 0.0 110.755 176.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.6 mttt 57.47 165.81 0.07 OUTLIER Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 125.833 1.653 . . . . 0.0 111.77 -165.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -75.46 -32.85 4.57 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 CA-C-N 120.332 1.154 . . . . 0.0 112.777 -176.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 47.2 t -80.11 67.55 5.96 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.061 1.345 . . . . 0.0 109.043 -177.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -157.2 -167.19 2.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.033 1.733 . . . . 0.0 107.29 159.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.2 m -109.85 105.13 14.21 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 120.238 1.381 . . . . 0.0 107.622 174.095 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -138.08 159.21 69.25 Favored Pre-proline 0 C--O 1.237 0.446 0 CA-C-N 118.995 0.816 . . . . 0.0 112.709 -171.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -72.86 164.38 35.73 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.467 2.778 . . . . 0.0 111.263 173.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.52 137.68 58.31 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.581 169.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.2 31.42 11.9 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-O 119.392 -0.671 . . . . 0.0 113.725 164.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 13.9 m -135.74 22.72 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-N 118.549 1.175 . . . . 0.0 109.988 171.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -63.27 -9.59 12.26 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 116.928 2.196 . . . . 0.0 116.928 -150.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -147.52 26.61 1.04 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 128.703 2.801 . . . . 0.0 111.324 172.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -78.49 153.93 30.95 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.064 0.946 . . . . 0.0 109.254 176.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.2 m -76.17 151.73 36.85 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 124.499 1.12 . . . . 0.0 108.684 163.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -133.85 145.56 49.8 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 124.129 0.972 . . . . 0.0 110.375 167.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 18.6 mt -115.75 137.77 51.76 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.406 1.883 . . . . 0.0 106.213 175.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 p -149.66 167.8 2.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 104.425 -2.435 . . . . 0.0 104.425 -179.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -109.75 153.59 24.12 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 120.213 -1.555 . . . . 0.0 108.326 167.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.52 3.02 12.22 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -100.33 -47.85 4.78 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 118.866 0.757 . . . . 0.0 109.977 159.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -76.58 24.91 0.14 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.138 1.775 . . . . 0.0 112.453 -174.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -56.09 -28.87 59.44 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.555 1.542 . . . . 0.0 113.683 -164.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -128.0 11.71 6.59 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 127.139 2.176 . . . . 0.0 111.174 174.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -88.18 -56.92 1.97 Allowed Glycine 0 CA--C 1.53 0.98 0 C-N-CA 125.369 1.461 . . . . 0.0 111.105 176.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 75.0 m -127.97 161.4 29.22 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.102 1.361 . . . . 0.0 108.016 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.8 tt -156.98 154.85 5.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 O-C-N 120.382 -1.449 . . . . 0.0 107.671 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 64.5 mt -135.02 150.42 29.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 169.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -124.24 158.86 31.49 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 126.977 2.111 . . . . 0.0 108.917 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -162.72 162.74 26.93 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.974 0.909 . . . . 0.0 110.1 171.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.5 131.09 10.63 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 170.171 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.78 150.38 24.61 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 123.957 0.785 . . . . 0.0 109.554 171.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -117.04 -3.45 11.57 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.256 1.822 . . . . 0.0 111.253 174.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 135.96 -37.19 1.93 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 124.879 1.228 . . . . 0.0 112.258 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.418 ' O ' ' HG ' ' A' ' 110' ' ' LEU . 0.5 OUTLIER -131.13 -59.54 0.98 Allowed 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 125.951 1.7 . . . . 0.0 107.14 166.79 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.4 m -73.16 143.07 47.39 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 119.604 -1.935 . . . . 0.0 110.559 -175.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 71.3 t -133.35 116.06 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 -175.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.8 mp -84.36 94.71 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.467 HG21 HD13 ' A' ' 36' ' ' ILE . 4.4 mt -71.24 127.94 33.8 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 171.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.9 mttt -129.01 108.34 10.32 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -129.37 168.47 16.23 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 121.133 -0.979 . . . . 0.0 109.938 -171.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.5 t -154.63 169.62 23.44 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.524 1.129 . . . . 0.0 108.778 -176.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.6 p -99.32 -14.02 19.39 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.661 0.784 . . . . 0.0 111.86 162.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -134.71 126.93 30.02 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.337 1.055 . . . . 0.0 111.556 -176.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 57.4 ttt-85 -56.59 -30.33 63.07 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 126.681 1.992 . . . . 0.0 112.579 -173.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.92 50.28 1.09 Allowed 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 124.767 1.227 . . . . 0.0 109.889 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.1 p -135.74 156.69 48.43 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.245 1.018 . . . . 0.0 108.511 164.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.33 149.17 46.38 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.247 -0.908 . . . . 0.0 111.15 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -83.89 154.54 23.37 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.983 1.313 . . . . 0.0 110.97 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -71.44 171.29 11.55 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 125.876 1.671 . . . . 0.0 111.112 171.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -114.92 117.26 30.15 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.479 1.512 . . . . 0.0 108.565 167.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.529 ' HE2' HD11 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -134.61 115.62 14.06 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 104.114 -2.55 . . . . 0.0 104.114 156.033 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.09 122.39 39.94 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 -172.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.403 HD11 ' HD2' ' A' ' 106' ' ' LYS . 35.6 mt -138.46 145.55 41.0 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.567 1.147 . . . . 0.0 108.674 -168.276 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 20.7 p -77.18 151.63 35.18 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.313 0.506 . . . . 0.0 110.73 175.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 89' ' ' GLN . 12.3 mt -51.0 -42.08 60.11 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 122.237 1.017 . . . . 0.0 110.807 175.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -35.89 70.49 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 125.091 1.357 . . . . 0.0 111.547 -176.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -68.03 0.37 Allowed 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 126.575 1.95 . . . . 0.0 109.652 174.538 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.61 -38.02 71.48 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.657 1.183 . . . . 0.0 111.279 -173.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -60.32 -34.14 73.38 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.956 0.502 . . . . 0.0 112.155 176.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -69.27 -58.94 3.38 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 120.787 -1.195 . . . . 0.0 108.069 173.909 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -45.87 -57.25 4.49 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.97 2.108 . . . . 0.0 110.537 -175.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -120.49 12.81 11.66 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.041 1.336 . . . . 0.0 112.298 -163.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -147.84 28.44 0.94 Allowed 'General case' 0 C--N 1.342 0.268 0 CA-C-N 120.08 1.309 . . . . 0.0 114.19 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 8.4 pm0 -68.82 -60.14 2.59 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 120.758 -1.214 . . . . 0.0 111.915 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 11.0 t -99.6 163.63 12.42 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 125.362 1.465 . . . . 0.0 109.88 -164.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 53.2 mtt-85 -80.2 -38.29 31.48 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -167.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 8.1 t -57.45 -38.63 74.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.708 0.686 . . . . 0.0 109.654 174.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -62.94 -25.31 68.28 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.684 -0.635 . . . . 0.0 112.368 176.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -71.66 -12.86 61.55 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 117.511 -1.233 . . . . 0.0 111.885 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -71.19 -73.07 0.19 Allowed 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 115.993 -1.956 . . . . 0.0 106.353 162.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -47.71 -55.14 10.16 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 120.243 1.383 . . . . 0.0 112.437 -166.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 78.3 t -54.45 -50.14 60.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 123.59 0.756 . . . . 0.0 110.391 -175.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.71 -34.03 73.33 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 176.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -64.14 -31.62 72.88 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 125.816 1.646 . . . . 0.0 108.835 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.436 ' HA ' HD13 ' A' ' 45' ' ' ILE . 22.0 m-30 -68.39 -41.42 80.56 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.348 1.459 . . . . 0.0 110.957 171.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.67 -35.14 74.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-N 119.296 0.953 . . . . 0.0 109.288 172.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -80.56 10.09 5.22 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.913 -1.117 . . . . 0.0 112.712 172.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -129.72 -5.15 4.56 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 125.954 1.74 . . . . 0.0 112.181 -172.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.723 ' HB3' HD23 ' A' ' 50' ' ' LEU . 4.0 pp -84.38 176.42 8.7 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 118.15 0.975 . . . . 0.0 110.377 167.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -138.2 163.37 31.88 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 128.7 2.8 . . . . 0.0 105.536 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.42 -5.79 15.1 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.244 1.021 . . . . 0.0 110.71 178.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 . . . . . 0 C--O 1.254 1.311 0 C-N-CA 130.169 3.387 . . . . 0.0 105.955 -177.329 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 . . . . . 0 CA--C 1.537 0.464 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.88 152.69 49.08 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.492 1.117 . . . . 0.0 110.124 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -48.44 -41.38 29.18 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.496 1.118 . . . . 0.0 110.193 173.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -50.31 -63.58 1.08 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.406 2.282 . . . . 0.0 110.487 174.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -70.34 -32.9 70.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.835 2.054 . . . . 0.0 111.354 -172.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 88.2 mt -71.93 -33.94 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 124.613 1.165 . . . . 0.0 108.818 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.36 -46.71 63.74 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 125.157 1.361 . . . . 0.0 111.06 -174.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 65.0 t -67.84 -46.62 81.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 123.276 0.63 . . . . 0.0 109.433 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.7 mp -58.78 -51.91 67.95 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.563 0.745 . . . . 0.0 111.503 -179.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.18 86.7 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.739 -0.648 . . . . 0.0 111.198 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.61 -28.6 72.07 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 118.79 0.723 . . . . 0.0 111.956 176.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mp -65.38 -24.93 67.36 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.35 -1.676 . . . . 0.0 112.44 176.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.42 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -78.57 -22.42 47.16 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 118.813 -0.613 . . . . 0.0 112.611 171.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.42 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.9 mp -130.1 92.12 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.519 1.528 . . . . 0.0 107.017 -172.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.16 63.78 1.08 Allowed Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 124.61 1.164 . . . . 0.0 111.594 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -59.31 -35.36 97.06 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.576 2.184 . . . . 0.0 111.165 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -68.86 -49.84 54.94 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.95 -175.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 59.5 t90 -52.22 -50.73 61.39 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 118.826 0.739 . . . . 0.0 109.796 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.1 tt -53.68 -59.27 4.83 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -62.86 -32.66 73.94 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 117.86 -1.067 . . . . 0.0 112.372 -175.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -63.85 -48.51 76.46 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 120.228 1.376 . . . . 0.0 108.858 176.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -65.85 -34.35 77.94 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 118.384 -0.817 . . . . 0.0 111.883 -177.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.517 HG21 ' CD1' ' A' ' 130' ' ' TYR . 45.1 mm -61.77 -49.72 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 119.428 1.013 . . . . 0.0 109.37 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.73 -3.08 4.27 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.083 0.953 . . . . 0.0 113.324 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.84 -7.07 14.21 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.645 1.978 . . . . 0.0 112.378 172.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.9 t30 44.61 38.67 2.83 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.171 2.188 . . . . 0.0 111.203 -167.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.37 -5.07 19.29 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.491 1.517 . . . . 0.0 111.438 -175.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.62 138.61 36.44 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 92.9 t -118.0 150.47 20.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 126.316 1.846 . . . . 0.0 106.784 175.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -124.82 142.83 51.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.258 3.023 . . . . 0.0 105.616 174.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -167.24 -178.95 39.88 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 27.8 mm -119.1 137.55 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 125.76 1.624 . . . . 0.0 106.83 -176.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.512 HG13 HG11 ' A' ' 61' ' ' VAL . 23.8 t -43.99 -71.98 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.725 1.21 . . . . 0.0 112.606 175.102 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 47.0 mttt 55.06 165.04 0.05 OUTLIER Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.708 1.603 . . . . 0.0 113.03 -164.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -78.84 -22.22 9.06 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 121.008 1.138 . . . . 0.0 111.009 175.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.9 m -77.29 19.56 0.33 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.189 1.796 . . . . 0.0 113.743 -172.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -132.8 177.89 7.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.598 1.559 . . . . 0.0 109.124 176.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.1 m -91.33 112.08 23.84 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.849 1.26 . . . . 0.0 107.902 173.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.512 HG11 HG13 ' A' ' 55' ' ' VAL . 5.7 m -144.47 162.23 40.37 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 123.665 0.786 . . . . 0.0 110.429 -177.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.25 -172.83 1.11 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.315 2.677 . . . . 0.0 112.211 171.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.04 162.23 28.56 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.297 1.039 . . . . 0.0 111.552 165.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.32 33.64 78.2 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 123.93 0.776 . . . . 0.0 113.514 160.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.9 m -144.14 27.15 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 118.39 1.095 . . . . 0.0 111.606 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.79 -16.35 4.34 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -163.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -149.62 15.4 0.87 Allowed 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 128.352 2.661 . . . . 0.0 110.424 -170.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -74.68 132.08 41.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.6 m -68.03 149.33 49.83 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 166.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -136.71 164.32 28.51 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.388 -0.82 . . . . 0.0 110.689 173.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 16.7 mt -139.23 135.88 34.39 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 126.968 2.107 . . . . 0.0 105.878 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.46 ' HB ' HG13 ' A' ' 81' ' ' ILE . 11.8 p -156.17 158.26 3.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -174.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.412 ' HB3' ' H ' ' A' ' 76' ' ' ASP . . . -84.97 154.31 22.23 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.107 -0.996 . . . . 0.0 108.391 168.165 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.49 -16.01 62.86 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.452 -0.785 . . . . 0.0 112.9 175.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -104.03 -39.19 6.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.667 173.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.412 ' H ' ' HB3' ' A' ' 73' ' ' ALA . 1.7 m-20 -82.15 28.79 0.43 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.634 1.174 . . . . 0.0 110.548 -167.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -49.71 -53.66 23.38 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 126.491 1.916 . . . . 0.0 110.534 -169.287 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -92.51 7.97 40.85 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.045 1.338 . . . . 0.0 113.045 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.2 -68.54 1.02 Allowed Glycine 0 CA--C 1.529 0.919 0 C-N-CA 126.263 1.887 . . . . 0.0 111.432 -176.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.7 m -134.8 143.09 46.88 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.814 1.307 . . . . 0.0 108.987 173.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.46 HG13 ' HB ' ' A' ' 72' ' ' VAL . 7.6 tt -143.44 157.89 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 171.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.2 mt -141.8 137.91 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 176.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -118.09 156.35 28.8 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 124.646 1.178 . . . . 0.0 108.64 176.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -161.02 158.47 27.94 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 120.997 -1.064 . . . . 0.0 110.593 174.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.53 110.16 4.67 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 166.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.24 124.71 32.19 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -151.87 150.79 30.48 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.307 2.243 . . . . 0.0 110.769 -177.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 46.42 53.4 9.66 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.872 1.225 . . . . 0.0 113.815 171.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 53.9 mm-40 57.73 12.11 1.54 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.498 1.919 . . . . 0.0 115.069 -172.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.5 m -128.08 170.23 13.17 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 128.443 2.697 . . . . 0.0 109.119 -168.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.6 p -156.05 109.59 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.689 0 O-C-N 121.003 -1.061 . . . . 0.0 112.616 174.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.665 HD12 ' H ' ' A' ' 92' ' ' ILE . 1.6 mp -79.03 95.38 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 173.075 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 19.2 mt -76.34 128.16 37.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 165.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -118.02 110.75 18.05 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 126.366 1.866 . . . . 0.0 106.405 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.413 ' CD2' HG12 ' A' ' 36' ' ' ILE . 34.7 p90 -126.78 164.96 20.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.146 0.884 . . . . 0.0 112.913 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.6 t -148.75 172.03 15.26 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.958 1.703 . . . . 0.0 108.615 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.6 p -114.93 -1.41 13.13 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.729 1.612 . . . . 0.0 111.953 169.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -143.21 143.28 31.69 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 160.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.0 mtm180 -60.44 -10.87 5.46 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -101.84 1.27 36.88 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.8 p -113.24 156.36 23.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.132 0.967 . . . . 0.0 112.612 -174.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -64.68 132.69 50.39 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 125.847 1.659 . . . . 0.0 109.926 -168.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.4 mt -78.23 140.58 38.9 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -173.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -66.9 -174.33 0.32 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.676 1.19 . . . . 0.0 110.793 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.32 101.83 4.63 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.381 1.072 . . . . 0.0 108.996 178.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -121.29 113.24 19.65 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 103.81 -2.663 . . . . 0.0 103.81 174.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -126.58 106.1 9.18 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 116.319 -1.8 . . . . 0.0 108.031 -166.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 26.7 mt -128.2 154.7 45.52 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 120.71 1.595 . . . . 0.0 109.143 -158.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 22.1 p -73.79 147.21 43.62 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 121.258 1.845 . . . . 0.0 111.44 176.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.6 mt -46.7 -48.89 20.13 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 122.919 1.343 . . . . 0.0 109.77 167.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.24 -15.69 62.46 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.01 0.924 . . . . 0.0 112.281 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -75.83 -56.47 4.64 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 171.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -55.14 -37.61 67.17 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.827 1.194 . . . . 0.0 111.834 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -56.83 -47.72 79.67 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.848 -0.533 . . . . 0.0 110.293 173.181 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -20.37 63.37 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.164 -0.922 . . . . 0.0 112.564 -176.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -83.01 -57.47 3.27 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.532 0.733 . . . . 0.0 110.952 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -116.28 0.94 13.0 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.391 -0.818 . . . . 0.0 113.064 -163.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.434 ' HA ' HE21 ' A' ' 123' ' ' GLN . 1.6 t80 -138.18 26.9 2.64 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -174.024 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.82 -26.96 40.33 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 174.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 66.2 p -80.09 -165.54 0.86 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.187 0.903 . . . . 0.0 110.972 -168.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 24.7 ttm-85 -114.53 -33.3 5.61 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.486 1.114 . . . . 0.0 111.779 172.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.3 p -62.11 -48.09 81.72 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 126.311 1.845 . . . . 0.0 110.874 174.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.434 HE21 ' HA ' ' A' ' 118' ' ' TYR . 2.7 pm0 -58.03 -25.79 61.6 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -172.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -65.44 -4.43 5.71 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.018 1.327 . . . . 0.0 112.774 175.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -80.08 -83.51 0.1 Allowed 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 105.255 -2.128 . . . . 0.0 105.255 154.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -55.01 -56.46 19.46 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 124.168 0.987 . . . . 0.0 113.533 -160.234 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.17 -21.77 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.131 0.972 . . . . 0.0 111.483 -175.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.62 -39.42 14.08 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.243 1.817 . . . . 0.0 109.924 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -59.55 -40.05 86.01 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 126.987 2.115 . . . . 0.0 110.667 174.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.517 ' CD1' HG21 ' A' ' 45' ' ' ILE . 17.8 m-30 -60.54 -33.08 72.14 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 125.201 1.4 . . . . 0.0 110.783 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 24.2 t -68.58 -13.9 17.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 O-C-N 121.583 -0.698 . . . . 0.0 110.772 175.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -116.08 17.64 15.74 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.286 1.434 . . . . 0.0 111.111 172.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -122.54 -10.61 5.91 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 126.214 1.864 . . . . 0.0 111.788 178.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.31 165.74 24.48 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.412 1.085 . . . . 0.0 108.928 157.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -110.81 162.49 14.74 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 127.426 2.29 . . . . 0.0 107.03 172.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.4 m -132.35 17.67 4.45 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.931 0.492 . . . . 0.0 110.376 176.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 . . . . . 0 C--O 1.25 1.122 0 C-N-CA 128.74 2.816 . . . . 0.0 108.15 -170.347 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 . . . . . 0 C--O 1.239 0.536 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 p -135.51 150.92 49.91 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 125.134 1.373 . . . . 0.0 108.585 177.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -57.35 -38.73 74.59 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.348 0.659 . . . . 0.0 110.819 -174.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -48.96 -61.28 2.14 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.465 2.306 . . . . 0.0 111.889 172.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 -66.74 -40.05 88.18 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.989 1.716 . . . . 0.0 109.456 -172.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.415 HG21 ' HB2' ' A' ' 86' ' ' ALA . 67.3 mt -61.89 -35.49 68.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 173.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.77 -51.05 59.31 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-O 118.187 -1.34 . . . . 0.0 111.232 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 76.3 t -58.3 -50.23 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 118.134 0.967 . . . . 0.0 109.18 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.4 mp -55.71 -49.82 71.99 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.259 1.024 . . . . 0.0 112.008 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.19 -42.78 93.25 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.919 -0.562 . . . . 0.0 111.32 -177.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.11 -25.24 74.54 Favored Glycine 0 C--N 1.337 0.629 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.095 176.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 tp -66.53 -24.15 66.34 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.307 -1.702 . . . . 0.0 111.74 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.425 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -77.92 -22.82 49.06 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 170.282 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.425 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.8 mp -136.59 101.34 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.543 1.537 . . . . 0.0 106.927 -170.249 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m 64.49 59.2 1.54 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.73 1.212 . . . . 0.0 112.904 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.82 -43.21 12.94 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.33 2.687 . . . . 0.0 112.165 176.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -53.74 -55.28 27.72 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.467 1.03 . . . . 0.0 110.164 -177.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 63.0 t90 -53.33 -42.17 66.46 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.61 1.164 . . . . 0.0 110.714 176.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.59 -53.6 32.67 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 -174.109 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -58.15 -44.22 87.74 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 123.857 0.863 . . . . 0.0 110.69 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -55.8 -52.35 64.31 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.939 0.896 . . . . 0.0 109.919 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -71.37 -24.39 62.07 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.498 -0.763 . . . . 0.0 111.482 -174.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.46 HG21 ' HD1' ' A' ' 130' ' ' TYR . 24.5 mm -72.18 -38.75 63.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 120.095 1.316 . . . . 0.0 110.579 167.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.09 -6.52 9.17 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.511 1.051 . . . . 0.0 112.756 -178.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.07 10.26 8.14 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.235 1.414 . . . . 0.0 112.267 167.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 50.67 27.44 2.98 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 128.78 2.832 . . . . 0.0 112.521 -178.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -82.77 -8.19 59.6 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 127.045 2.138 . . . . 0.0 112.823 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.8 tp -76.5 147.43 37.81 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.537 1.062 . . . . 0.0 110.225 -175.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.9 t -123.89 159.36 29.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 125.614 1.566 . . . . 0.0 107.782 170.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -129.65 144.54 51.33 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.669 2.787 . . . . 0.0 107.56 173.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -161.5 173.97 37.97 Favored Glycine 0 C--N 1.335 0.522 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 174.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 23.6 mm -106.3 147.77 11.42 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 168.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.631 HG13 HG11 ' A' ' 61' ' ' VAL . 26.7 t -50.72 -77.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 126.103 1.761 . . . . 0.0 112.346 173.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 38.3 mtmt 57.43 165.43 0.07 OUTLIER Pre-proline 0 CA--C 1.541 0.622 0 C-N-CA 126.477 1.911 . . . . 0.0 114.439 -170.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -78.83 64.62 8.76 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 123.078 2.518 . . . . 0.0 109.471 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.1 m -140.29 -17.02 0.92 Allowed 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.205 1.802 . . . . 0.0 112.728 -167.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -146.36 161.5 40.22 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 119.479 1.036 . . . . 0.0 108.985 -168.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 84.9 m -70.93 117.43 12.42 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 119.832 1.196 . . . . 0.0 107.969 173.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.631 HG11 HG13 ' A' ' 55' ' ' VAL . 30.4 m -139.96 159.37 64.76 Favored Pre-proline 0 C--O 1.236 0.352 0 C-N-CA 124.79 1.236 . . . . 0.0 109.161 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.491 ' HG3' HD21 ' A' ' 103' ' ' LEU . 83.9 Cg_endo -72.13 -178.44 3.23 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 121.72 1.614 . . . . 0.0 109.882 169.455 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.09 163.34 28.3 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.355 169.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.79 16.83 69.33 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-O 118.201 -1.333 . . . . 0.0 114.067 166.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.2 m -141.35 19.06 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 CA-C-N 119.115 1.458 . . . . 0.0 113.427 -171.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -57.22 -12.72 2.49 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 127.101 2.16 . . . . 0.0 116.245 -167.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -142.99 14.78 1.9 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.489 1.516 . . . . 0.0 111.813 175.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -70.07 148.1 49.2 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.181 -0.949 . . . . 0.0 108.993 176.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.3 m -72.89 157.79 36.76 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 124.14 0.976 . . . . 0.0 109.779 163.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -136.21 162.17 33.72 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.645 1.178 . . . . 0.0 110.146 163.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 10.1 mt -133.98 136.44 44.13 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 171.004 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.43 ' HB ' HG13 ' A' ' 81' ' ' ILE . 14.5 p -154.19 -177.99 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 104.9 -2.259 . . . . 0.0 104.9 -179.12 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -132.38 158.44 41.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 120.527 -1.358 . . . . 0.0 110.412 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.83 -17.26 62.75 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 125.653 1.581 . . . . 0.0 114.65 -161.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -117.41 -19.37 9.54 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.332 0.653 . . . . 0.0 111.404 175.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -88.82 38.35 0.88 Allowed 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.818 -1.176 . . . . 0.0 109.995 -178.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -50.98 -52.34 43.65 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.189 -0.944 . . . . 0.0 112.894 -167.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -95.86 2.68 53.83 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.946 0.499 . . . . 0.0 111.456 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.43 -66.66 1.96 Allowed Glycine 0 CA--C 1.527 0.833 0 C-N-CA 125.323 1.439 . . . . 0.0 112.602 -169.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.2 m -144.55 154.1 42.52 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.801 1.24 . . . . 0.0 107.707 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.43 HG13 ' HB ' ' A' ' 72' ' ' VAL . 6.6 tt -153.12 148.91 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-N 119.916 1.234 . . . . 0.0 108.161 174.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.484 HG23 ' HB3' ' A' ' 95' ' ' TYR . 24.0 mt -136.78 149.98 26.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 120.601 -1.312 . . . . 0.0 108.704 172.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -125.07 162.64 24.13 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 126.49 1.916 . . . . 0.0 109.369 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -162.16 160.36 27.08 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.103 -0.998 . . . . 0.0 111.777 175.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -142.88 111.34 6.21 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.907 0.883 . . . . 0.0 109.009 161.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HB2' HG21 ' A' ' 28' ' ' ILE . . . -81.86 102.74 11.04 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 173.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -96.2 90.49 5.51 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 126.389 1.876 . . . . 0.0 106.385 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.91 -137.4 43.93 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.71 5.22 0.13 Allowed 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 116.473 -1.727 . . . . 0.0 115.187 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.0 157.21 44.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 121.657 2.026 . . . . 0.0 110.61 -175.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.4 p -137.12 118.65 18.44 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 O-C-N 120.908 -1.12 . . . . 0.0 113.552 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 13.5 mm -78.5 94.05 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 172.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.421 ' CD1' HD23 ' A' ' 108' ' ' LEU . 27.1 mt -67.68 125.5 25.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 164.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -121.69 95.36 4.64 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 176.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.484 ' HB3' HG23 ' A' ' 82' ' ' ILE . 51.3 p90 -110.11 163.71 13.33 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.563 -1.336 . . . . 0.0 111.653 -177.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -147.23 166.73 26.14 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 170.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.3 p -98.24 -12.09 21.98 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.355 1.462 . . . . 0.0 111.108 171.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -140.13 132.88 29.02 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.924 0.89 . . . . 0.0 108.714 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -55.38 -25.67 36.76 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.04 1.336 . . . . 0.0 112.208 177.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -83.14 -5.29 59.06 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 118.293 2.701 . . . . 0.0 118.293 -178.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.6 p -116.71 161.53 19.1 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.488 1.04 . . . . 0.0 113.774 -169.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.1 tmtt? -64.76 153.08 40.91 Favored 'General case' 0 C--N 1.346 0.419 0 C-N-CA 123.249 0.62 . . . . 0.0 109.71 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.491 HD21 ' HG3' ' A' ' 62' ' ' PRO . 1.4 mm? -88.01 139.58 30.37 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.211 0.529 . . . . 0.0 109.694 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -61.45 174.32 0.76 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.961 0.904 . . . . 0.0 109.713 164.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -132.4 124.47 28.74 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 174.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -127.87 123.13 34.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 162.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.08 127.85 43.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 114.894 -2.479 . . . . 0.0 106.31 172.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.421 HD23 ' CD1' ' A' ' 93' ' ' ILE . 4.0 mm? -124.69 137.45 54.35 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 122.813 2.551 . . . . 0.0 108.479 179.136 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.9 p -64.6 148.43 50.87 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.213 172.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.5 mt -49.62 -42.21 44.34 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 121.35 0.595 . . . . 0.0 109.939 165.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.6 t -62.63 -45.77 91.32 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.459 -177.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -52.26 -61.02 2.54 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 118.551 0.614 . . . . 0.0 110.428 175.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.79 -32.62 72.92 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.714 0.265 . . . . 0.0 111.714 -171.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -66.12 -40.8 90.97 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.546 -0.721 . . . . 0.0 110.052 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -49.53 40.72 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 117.636 -1.173 . . . . 0.0 110.752 -177.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.16 -57.16 12.88 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.211 1.804 . . . . 0.0 108.367 177.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -118.55 16.49 13.73 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -159.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.509 ' CE1' ' HA ' ' A' ' 124' ' ' LYS . 1.5 t80 -147.21 26.59 1.07 Allowed 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -179.148 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . 0.272 5.0 pm0 -79.4 -52.96 7.39 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.891 -1.131 . . . . 0.0 113.793 -178.146 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.0 p -85.13 159.46 20.15 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.72 1.6 . . . . 0.0 111.638 -172.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -63.27 -45.05 93.3 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 116.774 -1.584 . . . . 0.0 113.932 176.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.7 t -61.49 -39.73 92.0 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 120.152 1.342 . . . . 0.0 108.815 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -56.18 -39.21 72.03 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.509 ' HA ' ' CE1' ' A' ' 118' ' ' TYR . 7.0 mtpm? -58.54 -37.28 75.35 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 118.361 -0.828 . . . . 0.0 112.88 178.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -60.92 2.15 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.32 -52.79 33.75 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.253 1.421 . . . . 0.0 111.249 -177.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 91.1 t -55.67 -48.97 77.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 124.167 0.987 . . . . 0.0 111.194 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -67.12 -31.88 72.64 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.484 0.714 . . . . 0.0 111.663 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.31 -41.76 97.53 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.758 1.623 . . . . 0.0 109.913 175.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.46 ' HD1' HG21 ' A' ' 45' ' ' ILE . 40.5 m-85 -61.01 -38.44 86.09 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 122.86 0.464 . . . . 0.0 112.102 177.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.3 t -64.07 -41.39 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.695 0.68 . . . . 0.0 109.793 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.37 -13.16 61.77 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -102.2 11.5 57.07 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.086 1.327 . . . . 0.0 113.541 -171.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.5 pp -117.22 173.17 6.83 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.108 0.963 . . . . 0.0 110.201 174.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -125.78 167.87 14.59 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 125.231 1.412 . . . . 0.0 108.174 -171.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.91 -6.12 6.18 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 122.306 1.05 . . . . 0.0 113.06 -175.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.061 1 C-N-CA 131.808 4.043 . . . . 0.0 104.983 -174.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 . . . . . 0 CA--C 1.536 0.407 0 CA-C-O 121.626 0.727 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.31 149.51 42.2 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 165.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -62.39 -35.38 79.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.69 -163.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -43.27 92.87 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.315 0.646 . . . . 0.0 109.907 -178.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -61.32 -36.48 80.23 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 123.257 0.623 . . . . 0.0 109.75 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.5 mt -69.2 -45.4 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -59.7 -36.58 90.23 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.257 -0.746 . . . . 0.0 113.468 -175.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.75 -48.7 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 117.732 0.766 . . . . 0.0 109.501 174.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.89 -44.21 96.7 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 118.719 0.691 . . . . 0.0 110.279 -178.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.62 -43.92 72.67 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.763 0.825 . . . . 0.0 109.775 175.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.99 -35.3 78.5 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.7 mp -62.62 -18.19 61.76 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.274 2.037 . . . . 0.0 112.271 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.422 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -86.23 -17.38 34.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.633 1.573 . . . . 0.0 114.072 171.433 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.422 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.9 mp -135.91 96.21 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 126.883 2.073 . . . . 0.0 106.902 -177.447 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 58.99 73.59 0.68 Allowed Pre-proline 0 CA--C 1.543 0.712 0 C-N-CA 127.59 2.356 . . . . 0.0 112.388 -178.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -60.34 -46.14 19.46 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.724 2.949 . . . . 0.0 111.916 172.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.33 -27.78 69.28 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.257 0.623 . . . . 0.0 112.042 -174.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -65.03 -65.13 0.71 Allowed 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.286 -0.884 . . . . 0.0 109.024 172.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 tt -52.16 -47.54 65.4 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.0 0.92 . . . . 0.0 110.724 -174.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -59.9 -46.94 87.74 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.65 0.78 . . . . 0.0 110.391 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -61.51 -41.7 97.7 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 119.092 0.86 . . . . 0.0 111.501 173.421 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -61.03 -49.07 78.88 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.788 0.722 . . . . 0.0 109.171 -176.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.5 mm -61.52 -34.35 61.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 123.938 0.895 . . . . 0.0 110.478 177.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.11 -9.01 19.28 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.933 -1.105 . . . . 0.0 112.931 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -123.46 10.7 9.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.305 1.042 . . . . 0.0 112.42 167.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 52.12 34.49 14.33 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.065 1.746 . . . . 0.0 111.938 -175.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -87.64 -0.64 57.16 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 126.941 2.097 . . . . 0.0 114.638 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 tp -90.69 134.51 34.36 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.371 1.068 . . . . 0.0 109.306 -171.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 53.8 t -118.63 153.53 20.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 126.062 1.745 . . . . 0.0 108.053 174.2 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -135.26 148.19 49.49 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 127.724 2.41 . . . . 0.0 107.451 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -163.38 173.4 39.51 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 170.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 25.4 mm -95.9 148.1 5.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 161.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.474 HG13 HG21 ' A' ' 61' ' ' VAL . 21.5 t -44.59 -59.19 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 C-N-CA 126.752 2.021 . . . . 0.0 113.647 178.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 mttt 58.77 165.41 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 126.348 1.859 . . . . 0.0 113.522 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -73.76 -25.29 14.73 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 121.837 1.691 . . . . 0.0 111.749 174.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.41 63.77 0.98 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.093 1.757 . . . . 0.0 110.399 -170.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -158.09 -169.23 2.73 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.482 2.313 . . . . 0.0 106.752 169.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 20.5 m -118.97 110.46 17.15 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 120.271 1.396 . . . . 0.0 108.725 172.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.474 HG21 HG13 ' A' ' 55' ' ' VAL . 31.6 m -135.44 163.09 53.32 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 124.89 1.276 . . . . 0.0 112.138 -175.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -75.61 172.86 15.5 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.111 3.207 . . . . 0.0 112.266 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.74 135.39 40.33 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.766 0.826 . . . . 0.0 111.038 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.77 45.13 6.14 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 125.326 1.441 . . . . 0.0 113.163 168.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.7 m -138.84 38.61 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 125.874 1.67 . . . . 0.0 109.392 173.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -65.47 -15.96 63.17 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -148.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -148.27 17.14 1.06 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 127.572 2.349 . . . . 0.0 111.344 175.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.514 ' CG ' ' HB2' ' A' ' 85' ' ' LYS . 3.4 m-85 -61.6 152.66 29.97 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 122.017 0.913 . . . . 0.0 109.358 177.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m -75.01 153.97 38.24 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 126.32 1.848 . . . . 0.0 108.706 165.009 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 33.9 p90 -137.36 163.62 30.58 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.39 1.076 . . . . 0.0 110.69 167.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.4 mt -141.83 133.05 26.35 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 127.422 2.289 . . . . 0.0 106.726 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.415 ' HB ' HG13 ' A' ' 81' ' ' ILE . 8.8 p -159.05 159.63 2.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.349 1.06 . . . . 0.0 108.672 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.403 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -86.93 146.85 26.0 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 119.095 0.861 . . . . 0.0 109.905 177.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.28 -10.69 11.71 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 126.676 1.991 . . . . 0.0 114.024 176.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -136.36 -6.95 2.0 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 125.678 1.591 . . . . 0.0 113.395 -169.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.403 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 33.5 t70 -130.14 37.61 3.88 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 125.931 1.692 . . . . 0.0 107.512 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.18 -39.3 28.85 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.332 0.653 . . . . 0.0 111.531 -173.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -90.1 -7.15 54.48 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.594 1.157 . . . . 0.0 112.574 -174.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.62 -65.86 1.39 Allowed Glycine 0 C--N 1.334 0.461 0 C-N-CA 124.426 1.012 . . . . 0.0 111.895 -167.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.99 128.04 33.57 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 -171.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.415 HG13 ' HB ' ' A' ' 72' ' ' VAL . 4.0 tt -137.58 149.36 25.45 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 176.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.473 HG23 ' HB3' ' A' ' 95' ' ' TYR . 45.4 mt -133.64 138.11 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 172.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -111.06 152.24 27.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 126.298 1.839 . . . . 0.0 106.828 172.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -154.11 163.43 40.11 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 121.171 -0.955 . . . . 0.0 108.821 171.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.514 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -146.94 109.81 4.68 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 173.426 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -77.06 82.36 3.57 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.417 1.087 . . . . 0.0 108.702 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -74.14 179.53 4.39 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.232 2.213 . . . . 0.0 109.32 172.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.84 117.48 6.68 Favored Glycine 0 CA--C 1.531 1.042 0 O-C-N 120.533 -1.354 . . . . 0.0 112.127 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 53.68 11.45 0.31 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.582 2.353 . . . . 0.0 114.267 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.3 m -143.78 159.33 42.7 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 120.288 1.404 . . . . 0.0 109.151 -166.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.0 t -133.82 116.73 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 167.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.45 ' N ' HD12 ' A' ' 92' ' ' ILE . 2.5 mp -84.36 102.6 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 168.348 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.45 134.39 27.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 175.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -134.18 97.98 4.0 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.755 1.622 . . . . 0.0 108.465 -175.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.473 ' HB3' HG23 ' A' ' 82' ' ' ILE . 40.9 p90 -122.57 168.49 12.1 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.612 -1.305 . . . . 0.0 110.554 -172.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.9 t -153.1 167.24 29.9 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.509 1.124 . . . . 0.0 109.045 -173.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.5 p -88.77 -15.25 35.14 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.501 0.72 . . . . 0.0 112.422 166.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -150.53 147.03 26.98 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.541 0.736 . . . . 0.0 110.683 -170.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.33 11.2 0.09 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.366 1.866 . . . . 0.0 113.546 176.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -136.44 10.13 3.19 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 117.219 2.304 . . . . 0.0 117.219 -177.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -116.33 158.74 22.95 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.152 0.501 . . . . 0.0 110.509 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.15 131.02 42.94 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 -175.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.457 ' H ' HD22 ' A' ' 103' ' ' LEU . 1.8 mm? -64.3 146.32 54.58 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.294 0.569 . . . . 0.0 110.065 -177.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -59.69 172.1 0.77 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.168 0.987 . . . . 0.0 109.936 163.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -130.23 108.24 9.88 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.188 0.995 . . . . 0.0 108.445 168.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -116.96 85.09 2.26 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 104.17 -2.53 . . . . 0.0 104.17 172.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -79.73 137.77 37.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 171.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.6 mt -143.9 147.79 34.5 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.86 149.77 39.44 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 118.432 0.56 . . . . 0.0 110.554 171.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.43 -38.07 71.07 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.658 0.783 . . . . 0.0 110.528 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.3 t -55.37 -42.59 74.14 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.794 177.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -56.59 19.49 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 123.495 0.718 . . . . 0.0 110.189 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.0 mt -55.0 -39.97 69.63 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 122.771 0.429 . . . . 0.0 111.206 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -69.95 -37.97 75.99 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.795 0.438 . . . . 0.0 110.915 -178.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -29.29 64.23 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.565 1.146 . . . . 0.0 111.156 177.125 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -88.83 -42.86 11.63 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 118.045 -0.978 . . . . 0.0 112.174 -169.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -133.14 14.89 4.21 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.895 0.771 . . . . 0.0 112.754 -176.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -135.83 26.95 3.32 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.637 -1.289 . . . . 0.0 112.892 177.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -93.2 -21.52 19.59 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 126.774 2.03 . . . . 0.0 113.28 -174.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.9 p -87.61 -167.74 1.99 Allowed 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 118.912 0.778 . . . . 0.0 110.324 -175.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 15.5 mmp_? -103.38 -43.31 5.46 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.72 0.808 . . . . 0.0 110.169 161.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.15 -22.65 67.02 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -175.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -65.08 -24.89 67.58 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 120.355 1.434 . . . . 0.0 110.981 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -65.9 -7.45 16.64 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 121.458 -0.776 . . . . 0.0 111.938 174.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.91 -75.86 0.24 Allowed 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 157.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -55.17 -55.6 29.38 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 113.736 1.014 . . . . 0.0 113.736 -166.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 57.8 t -58.83 -54.08 38.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 124.569 1.148 . . . . 0.0 109.754 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.27 -26.1 67.54 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -74.25 -42.56 59.46 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 125.036 1.335 . . . . 0.0 110.393 176.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -57.25 -41.7 80.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.252 0.621 . . . . 0.0 110.205 172.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 25.7 t -70.88 -30.12 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 O-C-N 121.175 -0.953 . . . . 0.0 111.126 177.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -77.54 -15.56 59.19 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.762 0.825 . . . . 0.0 112.596 175.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -105.92 7.2 41.22 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.919 1.723 . . . . 0.0 112.376 -172.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.91 146.69 27.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.563 1.182 . . . . 0.0 110.054 -172.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 12.7 mtt-85 -111.54 155.45 23.27 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 126.98 2.112 . . . . 0.0 109.427 -173.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.3 m -131.51 23.56 4.74 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 122.145 0.974 . . . . 0.0 110.744 -176.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 . . . . . 0 C--O 1.251 1.16 0 C-N-CA 128.696 2.799 . . . . 0.0 112.243 161.161 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 . . . . . 0 CA--C 1.534 0.347 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.8 p -135.6 166.97 21.99 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 177.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -57.44 -36.79 71.83 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.844 0.458 . . . . 0.0 110.618 -176.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -49.5 74.77 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.92 1.288 . . . . 0.0 110.858 178.091 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -39.77 81.2 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.204 1.002 . . . . 0.0 109.69 -175.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 85.9 mt -72.17 -36.49 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 C-N-CA 124.856 1.262 . . . . 0.0 109.809 -176.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -57.01 -33.72 64.53 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 123.653 0.644 . . . . 0.0 112.813 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.06 -55.8 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 118.146 0.973 . . . . 0.0 109.193 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.92 -42.22 75.75 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.98 0.912 . . . . 0.0 111.772 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.45 -51.05 69.88 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.35 1.86 . . . . 0.0 110.799 173.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.52 -25.65 75.3 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 123.264 0.459 . . . . 0.0 112.678 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 74.2 mt -67.49 -20.29 65.44 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 119.575 1.688 . . . . 0.0 112.412 176.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -81.48 -17.39 48.82 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.637 -0.664 . . . . 0.0 112.702 169.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.9 mm -142.95 101.1 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 N-CA-C 106.519 -1.659 . . . . 0.0 106.519 -158.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.2 m 55.8 54.47 9.07 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 123.295 0.638 . . . . 0.0 112.599 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.64 -40.64 44.92 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.121 2.548 . . . . 0.0 111.028 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -65.43 -47.78 75.04 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.774 -0.579 . . . . 0.0 110.29 -170.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -48.23 -45.88 34.75 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.61 1.964 . . . . 0.0 110.396 170.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.493 HD12 ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -67.16 -46.29 74.47 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -166.229 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -62.91 -37.73 88.15 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 117.05 -1.452 . . . . 0.0 111.552 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -59.22 -48.43 81.65 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 120.231 1.378 . . . . 0.0 108.989 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -64.9 -40.93 95.86 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 118.433 -0.794 . . . . 0.0 111.001 -172.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.9 mm -63.72 -44.81 98.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 119.284 0.947 . . . . 0.0 110.556 173.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.94 -11.25 26.64 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -116.51 7.6 13.77 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.297 1.439 . . . . 0.0 112.008 174.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 46.12 34.38 2.07 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.295 2.638 . . . . 0.0 112.969 -175.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -82.66 -13.54 56.26 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.7 1.6 . . . . 0.0 113.863 -177.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.6 tp -93.71 123.62 37.17 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.584 -0.698 . . . . 0.0 110.228 -156.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 79.0 t -104.36 140.71 21.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 124.541 1.136 . . . . 0.0 108.176 173.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -108.36 151.35 26.13 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 129.141 2.976 . . . . 0.0 106.841 169.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -165.4 173.9 41.17 Favored Glycine 0 N--CA 1.451 -0.306 0 O-C-N 121.517 -0.74 . . . . 0.0 111.658 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -107.8 143.37 18.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 163.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.726 HG13 HG11 ' A' ' 61' ' ' VAL . 27.2 t -48.5 -60.82 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 125.73 1.612 . . . . 0.0 113.703 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.2 mttt 60.63 165.92 0.09 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.866 1.666 . . . . 0.0 113.262 -170.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -72.7 -7.43 20.78 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.14 1.894 . . . . 0.0 112.514 171.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 m -70.04 -34.85 73.77 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.584 0.754 . . . . 0.0 112.437 -177.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -107.17 167.59 9.8 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 119.005 0.82 . . . . 0.0 112.163 -160.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.9 m -89.17 103.82 16.41 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.071 0.948 . . . . 0.0 109.555 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.726 HG11 HG13 ' A' ' 55' ' ' VAL . 28.9 m -140.45 156.58 69.47 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 123.602 0.761 . . . . 0.0 111.899 -164.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -71.84 179.28 4.93 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.649 2.233 . . . . 0.0 110.149 172.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.9 162.76 27.84 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.741 0.816 . . . . 0.0 110.228 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.8 13.56 82.99 Favored Glycine 0 CA--C 1.529 0.918 0 CA-C-O 118.907 -0.941 . . . . 0.0 113.376 171.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.659 ' O ' HG11 ' A' ' 55' ' ' VAL . 12.7 m -146.38 75.03 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 C-N-CA 125.685 1.594 . . . . 0.0 108.956 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.53 -15.29 33.28 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 119.964 -1.71 . . . . 0.0 113.183 173.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -150.81 5.72 0.51 Allowed 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 125.528 1.531 . . . . 0.0 110.933 -161.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -69.42 144.33 53.37 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 167.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.5 m -71.01 163.26 27.94 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.309 163.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -142.46 166.95 23.26 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.994 0.918 . . . . 0.0 111.118 169.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 20.4 mt -142.15 134.48 27.83 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 127.338 2.255 . . . . 0.0 107.55 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.6 p -160.95 157.64 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 125.992 1.717 . . . . 0.0 106.648 -171.248 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.465 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -77.0 157.39 31.22 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.022 -1.049 . . . . 0.0 109.022 167.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.07 -11.35 60.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 118.149 -0.929 . . . . 0.0 112.78 169.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -136.49 21.74 3.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.623 1.569 . . . . 0.0 110.896 -171.448 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.465 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 33.4 m-20 -140.71 43.98 1.83 Allowed 'General case' 0 N--CA 1.471 0.624 0 O-C-N 120.321 -1.487 . . . . 0.0 107.785 172.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.89 -48.33 80.96 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.1 -1.0 . . . . 0.0 110.654 -172.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -76.05 -3.67 37.1 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.48 -98.21 0.8 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.162 0.887 . . . . 0.0 112.166 -173.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 19.4 m -104.79 151.06 24.23 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.487 -1.008 . . . . 0.0 109.405 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.8 tt -153.83 154.41 7.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-N 119.256 0.934 . . . . 0.0 109.339 165.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 53.6 mt -130.25 127.05 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 171.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -102.67 155.79 18.07 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.03 1.332 . . . . 0.0 107.919 168.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 7.0 p90 -161.15 153.89 20.77 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 120.913 -1.117 . . . . 0.0 109.757 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.0 tttt -142.38 119.96 11.76 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 172.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.48 140.66 32.19 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.036 0.835 . . . . 0.0 109.077 169.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -134.72 84.09 2.08 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.212 1.805 . . . . 0.0 108.075 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 73.63 -49.06 1.63 Allowed Glycine 0 CA--C 1.529 0.956 0 C-N-CA 125.969 1.747 . . . . 0.0 113.237 175.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.405 ' O ' ' HG ' ' A' ' 110' ' ' LEU . 48.9 mt-30 -142.06 -43.51 0.34 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.96 2.104 . . . . 0.0 110.308 166.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 4.4 m -78.75 126.21 30.41 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 120.226 -1.546 . . . . 0.0 109.719 -165.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 23.8 t -105.65 113.39 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.1 mp -83.32 95.19 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 169.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.5 mt -76.55 117.51 21.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 172.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -113.08 83.7 1.87 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.467 1.907 . . . . 0.0 107.865 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -102.3 166.91 10.31 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 120.396 -1.44 . . . . 0.0 110.837 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 13.7 t -136.06 177.88 7.49 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 169.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.8 p -128.31 -3.07 5.6 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 126.228 1.811 . . . . 0.0 110.683 171.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -147.24 142.46 27.24 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 157.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 39.1 mmm-85 -57.74 -34.26 69.33 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.504 0.721 . . . . 0.0 112.834 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.76 13.6 0.62 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -179.049 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.0 p -132.92 158.89 41.47 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 119.482 1.037 . . . . 0.0 110.401 171.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.54 174.24 1.04 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-O 122.253 1.025 . . . . 0.0 110.968 171.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -83.66 149.57 26.43 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.653 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -177.39 0.39 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.224 1.81 . . . . 0.0 108.35 156.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -154.14 94.6 1.75 Allowed 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.006 -1.059 . . . . 0.0 111.558 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.7 tptt -101.43 119.98 39.59 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 173.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -114.44 123.42 49.39 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.922 1.289 . . . . 0.0 109.014 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 24.7 mt -142.84 141.42 31.59 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.322 1.049 . . . . 0.0 109.299 -168.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 p -78.78 148.71 32.85 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 120.411 1.459 . . . . 0.0 111.62 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 89' ' ' GLN . 9.7 mt -56.44 -30.82 63.32 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 120.855 -1.153 . . . . 0.0 111.937 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -46.92 77.46 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 124.257 1.023 . . . . 0.0 110.981 177.236 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -55.07 -59.56 4.59 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.575 -1.202 . . . . 0.0 108.99 168.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -48.09 -45.21 32.4 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.423 1.01 . . . . 0.0 111.538 -176.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -69.96 -30.94 68.42 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.47 0.708 . . . . 0.0 111.834 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -65.89 0.63 Allowed 'General case' 0 C--N 1.323 -0.548 0 O-C-N 120.758 -1.214 . . . . 0.0 107.873 169.507 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -44.54 -51.61 8.75 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.535 2.334 . . . . 0.0 110.311 -172.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -125.18 13.25 8.32 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.132 0.973 . . . . 0.0 111.932 -166.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -136.44 15.52 3.19 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 119.985 1.266 . . . . 0.0 112.375 172.611 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . 0.261 0.2 OUTLIER -62.11 -45.12 94.87 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 178.725 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.35 -176.11 2.13 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 119.934 1.243 . . . . 0.0 110.579 -164.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -25.02 39.16 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 119.197 -2.189 . . . . 0.0 111.29 170.009 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.35 -22.13 28.6 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 125.139 1.376 . . . . 0.0 109.563 -166.4 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.433 ' HB2' ' CD1' ' A' ' 118' ' ' TYR . 0.2 OUTLIER -54.94 -33.53 62.35 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.994 0.918 . . . . 0.0 110.644 173.343 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.84 -3.42 2.43 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.968 1.707 . . . . 0.0 113.109 178.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.06 -2.41 2.56 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 128.35 2.66 . . . . 0.0 111.903 -175.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -112.08 -70.18 0.82 Allowed 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 124.974 1.309 . . . . 0.0 108.174 174.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.6 t -49.33 -58.26 1.43 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 C-N-CA 124.915 1.286 . . . . 0.0 108.901 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -18.46 58.17 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -179.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -85.08 -43.23 14.08 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 125.84 1.656 . . . . 0.0 111.275 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -62.93 -34.49 77.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.25 0.62 . . . . 0.0 110.298 177.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 17.2 t -66.04 -16.73 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.051 -1.031 . . . . 0.0 111.167 173.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -106.58 2.48 26.1 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.408 1.483 . . . . 0.0 111.902 176.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -114.56 -6.68 19.33 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.474 1.035 . . . . 0.0 112.692 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -80.05 169.9 17.2 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.541 1.17 . . . . 0.0 110.229 173.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -124.5 162.56 23.72 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.635 1.974 . . . . 0.0 106.898 175.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.4 m -132.75 11.18 4.36 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.581 0.628 . . . . 0.0 111.807 -175.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 C--O 1.252 1.207 0 C-N-CA 124.208 1.003 . . . . 0.0 108.404 -157.321 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.1 p -88.13 159.87 18.02 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 173.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -48.54 -47.8 39.01 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.864 0.866 . . . . 0.0 110.488 173.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -55.08 32.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.867 0.867 . . . . 0.0 110.374 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -58.97 -43.87 91.43 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.734 1.613 . . . . 0.0 110.396 -173.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 85.1 mt -60.89 -45.27 98.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 125.521 1.528 . . . . 0.0 108.592 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -61.74 -35.12 90.76 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 124.206 0.907 . . . . 0.0 112.908 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.405 HG21 HG22 ' A' ' 131' ' ' VAL . 93.4 t -66.23 -51.8 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.107 0 CA-C-N 118.161 0.981 . . . . 0.0 108.634 177.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.35 -40.52 97.51 Favored 'General case' 0 CA--C 1.522 -0.097 0 O-C-N 121.947 -0.471 . . . . 0.0 111.661 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.17 -34.56 76.65 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.469 -0.3 . . . . 0.0 110.576 175.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.22 -28.65 57.8 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.16 -27.08 69.12 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.059 1.429 . . . . 0.0 111.247 170.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.432 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -74.13 -21.67 59.77 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.118 -0.988 . . . . 0.0 111.939 174.339 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.432 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.7 mp -131.07 91.92 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 125.558 1.543 . . . . 0.0 108.755 -171.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.18 67.5 0.92 Allowed Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.426 1.49 . . . . 0.0 110.041 -178.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -64.25 -33.19 60.72 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.716 2.277 . . . . 0.0 111.528 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -65.16 -48.02 74.99 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 117.56 -1.209 . . . . 0.0 110.32 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -48.7 -61.49 2.01 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.651 0.78 . . . . 0.0 109.912 168.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.419 HD22 HD11 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -45.45 -58.27 3.48 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.137 1.775 . . . . 0.0 109.94 -177.413 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -63.07 -44.58 95.4 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.787 1.235 . . . . 0.0 111.651 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -62.06 -32.88 73.45 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 119.372 0.987 . . . . 0.0 111.08 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -65.59 -50.34 65.46 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 41.8 mm -60.18 -36.59 69.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 118.518 0.599 . . . . 0.0 111.203 177.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.34 -12.42 21.0 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 118.675 0.67 . . . . 0.0 112.693 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.62 19.8 7.28 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.204 1.802 . . . . 0.0 111.761 172.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 51.71 23.77 2.13 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 127.747 2.419 . . . . 0.0 113.164 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -78.68 -26.45 45.0 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.785 1.234 . . . . 0.0 113.624 -165.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.419 HD11 HD22 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -76.81 145.11 38.67 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.473 1.509 . . . . 0.0 109.69 -157.608 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 22.0 t -124.31 158.39 31.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 126.453 1.901 . . . . 0.0 108.612 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -124.14 143.11 50.67 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 127.055 2.142 . . . . 0.0 106.571 165.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -149.15 163.97 29.22 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 110.252 -1.139 . . . . 0.0 110.252 169.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 20.1 mm -93.29 144.21 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 105.281 -2.118 . . . . 0.0 105.281 157.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 68' ' ' TYR . 28.1 t -45.18 -68.13 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 126.454 1.902 . . . . 0.0 112.394 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.7 mttt 59.76 150.75 0.09 OUTLIER Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 130.342 3.457 . . . . 0.0 113.178 -165.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -77.74 -16.35 14.72 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.172 1.915 . . . . 0.0 113.335 -170.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -69.25 -3.59 14.4 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.35 -0.844 . . . . 0.0 112.84 175.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -115.55 172.59 7.02 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.574 1.55 . . . . 0.0 108.593 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.9 m -108.9 123.94 49.86 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 -168.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.535 HG11 HG13 ' A' ' 55' ' ' VAL . 0.6 OUTLIER -142.64 155.82 63.36 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.025 0.93 . . . . 0.0 111.374 -170.283 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.536 ' HG2' HD21 ' A' ' 103' ' ' LEU . 8.2 Cg_endo -65.93 172.99 7.63 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.563 2.842 . . . . 0.0 111.171 164.264 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.15 139.81 44.76 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 121.323 -0.861 . . . . 0.0 111.861 -178.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.54 54.45 3.72 Favored Glycine 0 CA--C 1.488 -1.638 0 C-N-CA 126.201 1.858 . . . . 0.0 113.848 172.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.805 HG23 ' HB2' ' A' ' 68' ' ' TYR . 1.6 p 176.35 71.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 -169.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.9 -16.12 13.93 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.599 1.159 . . . . 0.0 111.27 176.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -145.2 12.71 1.39 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.406 2.282 . . . . 0.0 110.321 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.805 ' HB2' HG23 ' A' ' 65' ' ' VAL . 4.1 m-85 -62.21 147.42 47.89 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 168.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.4 m -71.9 159.94 33.4 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 163.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -140.55 155.84 46.48 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.4 1.08 . . . . 0.0 109.982 165.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -117.9 133.76 55.61 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 167.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.6 p -149.83 164.94 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.884 1.674 . . . . 0.0 106.783 169.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.432 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -98.31 149.66 22.38 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 119.982 1.264 . . . . 0.0 108.381 171.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.82 -18.69 64.37 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -172.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -136.04 26.43 3.27 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.535 2.334 . . . . 0.0 109.024 -175.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.432 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 25.7 t70 -128.88 39.22 3.83 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 128.138 2.575 . . . . 0.0 105.417 159.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -67.41 -50.3 60.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 127.159 2.184 . . . . 0.0 110.778 -161.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -96.84 39.88 1.16 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.539 1.536 . . . . 0.0 107.664 167.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -116.59 -126.08 3.82 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 126.247 1.879 . . . . 0.0 110.146 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.53 136.18 33.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 117.427 0.614 . . . . 0.0 109.976 -172.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.1 tt -140.19 151.09 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-O 121.585 0.707 . . . . 0.0 109.782 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.528 HG23 ' HB3' ' A' ' 95' ' ' TYR . 7.8 mt -134.9 108.72 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.038 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -77.08 152.98 34.79 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.155 0.889 . . . . 0.0 109.552 167.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.0 p90 -152.86 164.91 36.98 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.313 -1.492 . . . . 0.0 109.825 166.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -148.55 138.04 21.99 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 158.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -74.98 151.24 38.83 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 162.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -138.46 13.54 2.77 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.342 1.857 . . . . 0.0 111.444 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 103.5 100.84 2.61 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 108.79 -1.724 . . . . 0.0 108.79 -178.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 49.6 12.92 0.07 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.576 1.95 . . . . 0.0 115.097 -171.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.68 148.37 39.0 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.892 1.277 . . . . 0.0 107.688 -174.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 60.1 t -135.45 114.72 16.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 125.377 1.471 . . . . 0.0 107.743 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.46 HD12 ' H ' ' A' ' 92' ' ' ILE . 3.9 mp -79.38 101.23 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 167.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mt -79.65 113.11 18.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 169.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.437 ' HD2' ' CE2' ' A' ' 68' ' ' TYR . 13.0 mttt -109.76 100.41 9.42 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -178.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.528 ' HB3' HG23 ' A' ' 82' ' ' ILE . 43.6 p90 -124.7 174.18 8.05 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 121.548 -0.72 . . . . 0.0 110.869 -171.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.425 HG23 ' O ' ' A' ' 98' ' ' GLN . 1.5 t -169.42 164.72 10.64 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -173.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -13.38 60.52 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.076 0.95 . . . . 0.0 112.896 166.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.425 ' O ' HG23 ' A' ' 96' ' ' THR . 2.1 tt0 -135.56 -170.6 2.64 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.12 0.968 . . . . 0.0 110.754 -162.197 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.52 -70.38 0.8 Allowed 'General case' 0 CA--C 1.503 -0.839 0 C-N-CA 125.48 1.512 . . . . 0.0 109.798 -173.075 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -77.23 51.31 0.83 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.644 0.778 . . . . 0.0 112.554 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.1 p -141.81 165.51 27.28 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 119.734 -1.854 . . . . 0.0 111.283 176.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.04 161.55 24.14 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.599 -0.688 . . . . 0.0 110.734 174.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.536 HD21 ' HG2' ' A' ' 62' ' ' PRO . 1.2 mm? -114.42 160.43 19.18 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.877 1.271 . . . . 0.0 109.966 -163.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -73.96 177.16 5.82 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.511 0.724 . . . . 0.0 109.217 162.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.02 51.4 1.31 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.304 1.041 . . . . 0.0 112.043 -171.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.571 ' HE3' HD21 ' A' ' 108' ' ' LEU . 31.3 tptt -65.56 120.14 12.37 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 106.314 -1.735 . . . . 0.0 106.314 173.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -122.18 93.12 3.89 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 119.883 1.22 . . . . 0.0 108.361 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.571 HD21 ' HE3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -95.92 159.75 14.81 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 123.941 0.896 . . . . 0.0 108.722 178.296 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 68.6 p -73.96 155.2 38.89 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.625 167.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 28.3 mt -57.57 -39.12 76.02 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 120.361 -1.462 . . . . 0.0 109.405 166.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 t -63.54 -34.12 77.09 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 124.139 0.976 . . . . 0.0 111.195 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.66 -69.18 0.13 Allowed 'General case' 0 C--N 1.345 0.391 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 168.569 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -53.66 -35.26 60.83 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.255 0.622 . . . . 0.0 112.407 -169.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 7.9 tmtm? -62.28 -58.23 8.49 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 118.082 0.401 . . . . 0.0 110.695 173.046 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.87 -30.48 70.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.703 -170.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.3 -85.36 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.809 2.444 . . . . 0.0 108.023 170.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -90.03 -16.02 30.62 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -161.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -115.06 45.39 1.63 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.146 0.979 . . . . 0.0 110.156 -167.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.72 -37.48 27.24 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -164.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . 0.314 0.1 OUTLIER -101.17 -164.42 1.11 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.375 1.07 . . . . 0.0 109.968 -173.195 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.92 -22.47 16.3 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.959 1.704 . . . . 0.0 111.971 162.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 35.7 p -80.42 -31.17 37.67 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 117.619 -1.182 . . . . 0.0 110.841 -173.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -61.44 -30.09 70.36 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.397 1.453 . . . . 0.0 110.771 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 12.2 mtpt -52.8 -34.81 55.33 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 118.838 -0.601 . . . . 0.0 109.731 -178.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.47 -26.33 65.16 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.119 -0.943 . . . . 0.0 112.806 -178.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -99.86 -51.61 3.67 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 118.495 0.589 . . . . 0.0 110.065 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.3 t -59.26 -48.44 86.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 O-C-N 121.703 -0.623 . . . . 0.0 110.368 -174.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -61.98 -36.96 83.05 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 121.81 -0.556 . . . . 0.0 111.794 175.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -62.32 -42.8 99.68 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.223 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -58.91 -39.35 81.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.211 1.005 . . . . 0.0 110.306 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.405 HG22 HG21 ' A' ' 30' ' ' VAL . 97.8 t -68.95 -33.08 57.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 O-C-N 121.694 -0.629 . . . . 0.0 111.236 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -86.38 -16.28 37.8 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.128 0.877 . . . . 0.0 111.712 174.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.39 -46.29 6.56 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 125.72 1.629 . . . . 0.0 110.787 -178.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.1 pp -55.29 142.44 31.84 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.45 0.643 . . . . 0.0 109.805 176.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.26 171.68 11.73 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.801 1.641 . . . . 0.0 110.103 172.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.76 -5.48 11.57 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.876 0.87 . . . . 0.0 111.782 171.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 . . . . . 0 C--O 1.24 0.567 0 C-N-CA 130.919 3.688 . . . . 0.0 107.098 175.435 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 CA--C 1.538 0.512 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 p -126.53 149.27 49.48 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.251 1.42 . . . . 0.0 107.666 164.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -66.11 -23.89 66.59 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.602 1.161 . . . . 0.0 111.424 -169.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -56.65 -48.88 76.58 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.284 2.233 . . . . 0.0 109.798 170.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -67.72 -36.02 79.84 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.726 1.61 . . . . 0.0 110.742 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 97.6 mt -69.8 -42.84 80.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 C-N-CA 123.975 0.91 . . . . 0.0 111.037 -172.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -65.06 -29.93 76.65 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 119.062 0.847 . . . . 0.0 112.152 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.6 t -62.65 -56.73 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 171.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.4 mp -56.58 -40.36 75.11 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.706 0.802 . . . . 0.0 112.169 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.54 69.69 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.9 0.773 . . . . 0.0 111.069 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.05 -21.88 79.5 Favored Glycine 0 CA--C 1.533 1.168 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 mp -66.06 -22.45 66.42 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 120.268 -1.725 . . . . 0.0 112.116 170.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.85 -18.43 32.88 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.103 -0.951 . . . . 0.0 113.078 173.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -132.71 94.99 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -176.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 59.33 70.52 1.09 Allowed Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 126.698 1.999 . . . . 0.0 111.741 -174.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -56.94 -45.42 36.35 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 122.206 1.937 . . . . 0.0 110.584 173.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.43 -46.21 80.37 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.63 0.772 . . . . 0.0 112.091 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -57.18 -49.33 76.31 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 119.04 0.836 . . . . 0.0 109.559 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.0 tt -55.15 -58.2 8.65 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.8 mtpt -55.48 -39.97 71.09 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.544 1.138 . . . . 0.0 110.97 -174.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -67.6 -48.33 67.11 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 118.317 0.508 . . . . 0.0 111.019 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -66.26 -29.24 69.44 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.818 -176.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.4 mm -64.61 -45.39 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 119.706 1.139 . . . . 0.0 109.764 169.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.83 -10.06 34.53 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.972 -1.08 . . . . 0.0 112.759 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.86 -4.7 25.83 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.334 1.453 . . . . 0.0 112.991 171.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 46.1 39.8 6.36 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.329 1.452 . . . . 0.0 110.496 -167.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -105.68 -13.44 15.57 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.303 1.441 . . . . 0.0 112.373 -177.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.8 134.52 34.31 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.036 0.934 . . . . 0.0 108.93 -167.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.6 t -117.23 164.79 13.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 125.704 1.602 . . . . 0.0 109.232 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -144.21 110.56 5.51 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 129.698 3.199 . . . . 0.0 103.214 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.51 170.8 24.6 Favored Glycine 0 CA--C 1.518 0.253 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 170.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 42.2 mm -99.96 143.53 13.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -175.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.594 HG13 HG11 ' A' ' 61' ' ' VAL . 24.9 t -51.18 -60.43 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 C-N-CA 124.98 1.312 . . . . 0.0 111.538 174.547 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.5 mttt 60.14 165.69 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 125.361 1.464 . . . . 0.0 113.909 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -63.92 -25.83 67.02 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.865 1.71 . . . . 0.0 112.743 170.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 30.4 m -86.75 2.7 47.85 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -164.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -125.14 160.78 28.33 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 119.69 1.132 . . . . 0.0 110.548 -170.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.0 m -89.3 114.89 26.33 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.655 0.782 . . . . 0.0 109.101 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.594 HG11 HG13 ' A' ' 55' ' ' VAL . 6.0 m -143.04 165.24 27.16 Favored Pre-proline 0 C--O 1.237 0.436 0 O-C-N 121.369 -0.832 . . . . 0.0 112.428 -170.112 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.42 ' CG ' HD21 ' A' ' 103' ' ' LEU . 34.6 Cg_endo -66.89 165.0 27.49 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.136 2.557 . . . . 0.0 111.495 168.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.49 137.92 54.81 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 121.835 -0.54 . . . . 0.0 110.562 174.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.0 25.22 11.55 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-O 118.756 -1.024 . . . . 0.0 114.783 161.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.6 m -136.54 29.58 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 124.515 1.126 . . . . 0.0 110.883 -174.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -58.16 -16.27 12.83 Favored 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 117.584 2.439 . . . . 0.0 117.584 -153.204 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -156.2 32.56 0.33 Allowed 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 127.465 2.306 . . . . 0.0 108.985 172.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -69.4 155.91 39.68 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 167.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.67 153.8 36.94 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 161.058 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -136.81 149.49 47.78 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.724 0.809 . . . . 0.0 109.828 164.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.91 127.17 54.78 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 175.277 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -145.56 159.6 12.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 171.032 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.537 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -85.84 159.43 19.71 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 169.044 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.86 -18.78 57.98 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -122.95 7.69 9.29 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.75 1.62 . . . . 0.0 112.539 -173.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.537 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 14.2 t70 -110.38 21.18 16.98 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.0 0.92 . . . . 0.0 111.16 -174.508 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -49.08 -44.32 41.88 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 128.054 2.542 . . . . 0.0 113.096 -167.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -103.57 -8.81 19.75 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.967 0.907 . . . . 0.0 111.948 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.3 -69.36 1.4 Allowed Glycine 0 C--N 1.334 0.467 0 C-N-CA 125.73 1.633 . . . . 0.0 110.36 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.59 161.83 36.96 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.895 0.847 . . . . 0.0 110.815 -170.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tt -163.18 152.23 3.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 171.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.7 mt -133.36 143.67 38.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 168.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -118.5 149.91 40.5 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.826 1.651 . . . . 0.0 108.194 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -147.35 159.99 43.04 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.047 1.294 . . . . 0.0 111.87 171.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.0 tttm -154.85 110.59 3.14 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.173 0.589 . . . . 0.0 110.692 167.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.42 108.73 2.06 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 127.992 2.517 . . . . 0.0 112.87 172.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -121.45 97.58 5.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.726 1.21 . . . . 0.0 111.345 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 48.92 77.43 0.12 Allowed Glycine 0 CA--C 1.522 0.509 0 C-N-CA 124.317 0.961 . . . . 0.0 113.199 174.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 68.43 -86.56 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.503 1.921 . . . . 0.0 107.906 -155.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.2 m -64.11 131.63 48.08 Favored 'General case' 0 C--N 1.314 -0.962 0 C-N-CA 125.043 1.337 . . . . 0.0 113.769 -157.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 107' ' ' ALA . 2.8 m -101.05 114.6 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 O-C-N 121.089 -1.007 . . . . 0.0 111.424 -179.19 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.504 HD12 ' H ' ' A' ' 92' ' ' ILE . 4.3 mp -72.6 100.59 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 172.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.413 ' CD1' HD23 ' A' ' 108' ' ' LEU . 16.8 mt -81.08 139.76 17.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 167.276 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -129.7 112.53 13.74 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.273 1.429 . . . . 0.0 107.484 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.3 p90 -137.55 167.43 21.68 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 120.854 -1.154 . . . . 0.0 110.533 -168.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -153.48 170.86 19.71 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.681 0.753 . . . . 0.0 109.258 -173.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.88 0.6 13.8 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.257 1.023 . . . . 0.0 110.827 169.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -143.87 153.45 42.35 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 124.108 0.963 . . . . 0.0 111.557 168.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -77.78 1.96 18.58 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 121.421 -0.8 . . . . 0.0 112.409 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.58 1.45 14.27 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.038 1.495 . . . . 0.0 115.038 -174.088 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.6 p -120.04 173.09 7.29 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.722 0.809 . . . . 0.0 112.544 -165.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.7 tptt -71.26 132.1 44.45 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.597 0.759 . . . . 0.0 109.924 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.443 ' H ' HD22 ' A' ' 103' ' ' LEU . 1.9 mm? -64.18 132.29 49.96 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.243 0.544 . . . . 0.0 109.562 170.373 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -67.1 175.43 2.59 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 125.358 1.463 . . . . 0.0 109.425 164.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -124.48 153.07 42.56 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.895 1.278 . . . . 0.0 110.007 176.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.459 ' CD ' HD21 ' A' ' 108' ' ' LEU . 0.4 OUTLIER -165.3 109.63 0.87 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 127.567 2.347 . . . . 0.0 104.773 168.021 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.414 ' HA ' ' O ' ' A' ' 91' ' ' VAL . . . -97.05 121.5 39.01 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 115.412 -2.232 . . . . 0.0 108.073 -171.033 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.459 HD21 ' CD ' ' A' ' 106' ' ' LYS . 3.4 mm? -119.64 121.97 40.48 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 122.869 2.577 . . . . 0.0 110.782 -171.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.9 p -59.17 143.97 47.3 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.299 0.571 . . . . 0.0 109.946 176.22 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 29.3 mt -52.31 -31.58 33.69 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.612 -1.305 . . . . 0.0 112.166 171.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.1 t -64.05 -43.36 95.72 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 117.169 -1.396 . . . . 0.0 111.819 174.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -51.88 -65.58 0.53 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-N 119.57 1.077 . . . . 0.0 109.512 173.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -56.9 -34.23 67.7 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.354 0.525 . . . . 0.0 111.647 -169.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 ttmp? -70.71 -40.16 73.0 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 118.689 -0.672 . . . . 0.0 110.53 -177.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -59.15 3.95 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 173.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -47.46 -50.81 22.09 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 124.184 0.928 . . . . 0.0 111.978 -173.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -130.55 14.65 5.47 Favored 'General case' 0 C--O 1.226 -0.182 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -165.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -149.69 22.83 0.9 Allowed 'General case' 0 C--O 1.239 0.54 0 O-C-N 120.521 -1.362 . . . . 0.0 113.157 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -55.51 -29.04 58.13 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.094 1.758 . . . . 0.0 113.846 -176.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' THR . . . . . 0.417 HG23 ' H ' ' A' ' 123' ' ' GLN . 9.6 t -135.7 159.9 40.19 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.069 1.348 . . . . 0.0 111.052 -169.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -71.08 -33.02 69.81 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.867 176.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.57 -37.83 88.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 119.686 1.13 . . . . 0.0 109.918 -176.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.417 ' H ' HG23 ' A' ' 120' ' ' THR . 10.3 tt0 -63.27 -19.27 64.42 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.661 1.185 . . . . 0.0 112.955 175.106 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -55.72 -32.91 63.76 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 117.836 -1.078 . . . . 0.0 111.298 174.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -54.21 -59.19 5.0 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 124.039 0.837 . . . . 0.0 110.469 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.07 -47.04 39.29 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 123.35 0.66 . . . . 0.0 110.455 -168.211 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 58.1 t -56.4 -56.53 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -59.35 -31.09 68.88 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 118.529 -0.748 . . . . 0.0 113.014 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -67.68 -37.57 82.51 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 119.064 0.847 . . . . 0.0 111.187 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -61.64 -42.46 98.93 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.611 0.641 . . . . 0.0 109.595 171.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 15.4 t -63.1 -38.89 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 121.445 -0.784 . . . . 0.0 110.517 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -81.14 -18.87 44.9 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.824 0.85 . . . . 0.0 112.535 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -108.27 -5.59 32.31 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 125.531 1.539 . . . . 0.0 114.103 -177.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.6 pp -78.08 146.09 35.42 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 118.764 1.282 . . . . 0.0 108.953 170.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 2.7 mtp-105 -90.38 165.01 14.1 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 124.149 0.98 . . . . 0.0 108.978 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.0 m -121.69 6.07 9.99 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.696 0.798 . . . . 0.0 111.203 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . 0.331 7.8 pt-20 . . . . . 0 C--O 1.247 0.921 0 C-N-CA 129.47 3.108 . . . . 0.0 113.177 -162.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.3 p -93.57 165.58 12.67 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -56.36 -44.26 79.96 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.968 0.804 . . . . 0.0 110.211 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.36 -50.64 72.32 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.57 0.748 . . . . 0.0 110.03 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -59.01 -48.38 81.8 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.564 1.145 . . . . 0.0 109.708 -175.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.2 mt -65.5 -35.91 76.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -175.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -57.83 -36.6 80.62 Favored Glycine 0 C--N 1.338 0.654 0 CA-C-O 118.967 -0.907 . . . . 0.0 112.712 177.28 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 75.6 t -70.13 -46.45 72.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 118.176 0.988 . . . . 0.0 109.157 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 113' ' ' LEU . 3.1 mp -60.15 -46.31 90.09 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.398 1.079 . . . . 0.0 111.508 177.216 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.99 -48.66 64.31 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.676 1.19 . . . . 0.0 110.515 175.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.07 -30.36 77.53 Favored Glycine 0 C--N 1.337 0.623 0 CA-C-O 119.15 -0.806 . . . . 0.0 113.619 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 34' ' ' LEU . 68.3 mt -63.77 -22.59 66.98 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 119.698 1.749 . . . . 0.0 112.408 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.447 ' HB2' ' CE2' ' A' ' 117' ' ' PHE . . . -94.56 -16.39 23.3 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 118.526 -0.75 . . . . 0.0 112.272 174.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -126.59 94.64 2.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.0 65.88 2.22 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 125.417 1.487 . . . . 0.0 111.865 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.38 -44.17 48.65 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.067 2.511 . . . . 0.0 111.891 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -66.9 -38.74 86.81 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.971 0.908 . . . . 0.0 110.251 -173.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 75.7 t90 -55.66 -56.31 21.94 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.143 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.7 tt -54.86 -52.3 63.22 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.867 -0.52 . . . . 0.0 110.785 -178.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.7 mttm -56.24 -47.7 77.96 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.655 0.782 . . . . 0.0 111.65 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -66.07 -38.48 88.4 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 118.937 0.79 . . . . 0.0 110.15 -177.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -69.12 -42.04 76.58 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.648 0.658 . . . . 0.0 110.62 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 25.4 mm -57.62 -40.29 74.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 119.203 0.911 . . . . 0.0 110.645 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.86 -20.08 55.02 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -119.96 23.25 11.13 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 120.949 -1.095 . . . . 0.0 112.117 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.4 t30 45.18 35.41 1.7 Allowed 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.967 2.107 . . . . 0.0 110.748 -176.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -79.52 -12.66 59.86 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 121.28 -0.887 . . . . 0.0 109.799 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -107.77 123.55 48.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 119.144 0.884 . . . . 0.0 108.863 -156.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.478 HG12 HG13 ' A' ' 72' ' ' VAL . 3.5 p -111.11 142.98 21.9 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 C-N-CA 124.565 1.146 . . . . 0.0 109.427 -178.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -99.0 137.78 37.04 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 126.065 1.746 . . . . 0.0 106.703 163.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.06 178.64 30.83 Favored Glycine 0 CA--C 1.522 0.494 0 CA-C-N 119.349 0.977 . . . . 0.0 110.944 176.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 18.4 mm -115.07 146.59 19.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 125.557 1.543 . . . . 0.0 107.371 172.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.456 HG13 HG11 ' A' ' 61' ' ' VAL . 32.2 t -54.11 -75.49 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.253 1.273 0 C-N-CA 126.067 1.747 . . . . 0.0 110.935 171.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp 54.33 158.23 0.06 OUTLIER Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 129.291 3.036 . . . . 0.0 112.06 -156.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -70.87 -4.9 15.7 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 122.334 2.023 . . . . 0.0 111.526 167.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.4 m -67.98 3.55 1.52 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.53 1.932 . . . . 0.0 113.409 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -136.32 173.55 11.59 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.271 1.396 . . . . 0.0 110.668 -173.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 m -90.11 104.12 16.73 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.255 1.822 . . . . 0.0 108.118 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.456 HG11 HG13 ' A' ' 55' ' ' VAL . 4.0 m -150.44 154.39 35.66 Favored Pre-proline 0 C--O 1.238 0.488 0 O-C-N 121.894 -0.504 . . . . 0.0 111.625 -168.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.21 166.42 26.96 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.684 2.256 . . . . 0.0 110.954 175.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -76.79 146.93 37.55 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.477 0.711 . . . . 0.0 110.482 -174.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.01 32.53 44.16 Favored Glycine 0 CA--C 1.528 0.858 0 O-C-N 121.693 -0.629 . . . . 0.0 113.976 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.9 m -133.63 26.12 1.15 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-N 118.787 1.294 . . . . 0.0 109.806 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -61.05 -16.16 40.54 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -154.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -143.81 14.88 1.74 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 127.337 2.255 . . . . 0.0 111.516 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -66.27 146.29 54.78 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.52 161.98 29.76 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.159 163.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 21.4 p90 -135.55 172.25 13.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 125.23 1.412 . . . . 0.0 109.604 165.602 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.9 mt -130.91 135.84 48.04 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 106.181 -1.785 . . . . 0.0 106.181 168.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.478 HG13 HG12 ' A' ' 51' ' ' VAL . 3.7 p -149.19 152.64 11.82 Favored 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-N 120.431 1.469 . . . . 0.0 110.766 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.407 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -78.86 112.39 15.98 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 172.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.16 -9.66 18.14 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 129.565 3.146 . . . . 0.0 114.735 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -106.55 -39.33 5.89 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.478 0.711 . . . . 0.0 109.733 169.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 7.4 t0 -94.55 51.01 1.38 Allowed 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 -171.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -67.82 -2.67 7.63 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -166.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -124.45 14.35 8.86 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.194 1.798 . . . . 0.0 111.459 166.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -80.23 -88.09 0.55 Allowed Glycine 0 N--CA 1.448 -0.531 0 O-C-N 120.835 -1.165 . . . . 0.0 111.194 175.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.3 m -130.69 160.86 33.04 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 123.799 0.84 . . . . 0.0 109.291 -170.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.8 tt -154.25 153.79 7.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 169.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.47 HG23 ' HB3' ' A' ' 95' ' ' TYR . 8.7 mt -139.73 112.21 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 119.017 0.826 . . . . 0.0 109.503 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -86.34 154.7 21.02 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.22 0.918 . . . . 0.0 110.987 177.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.7 p90 -163.06 155.59 18.66 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.995 0.918 . . . . 0.0 109.682 172.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.7 tttt -143.25 113.45 7.27 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 123.976 0.91 . . . . 0.0 108.568 167.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -84.81 95.91 9.13 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -66.01 -2.69 4.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.371 0.669 . . . . 0.0 112.385 179.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 91.62 127.64 4.01 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 107.45 -2.26 . . . . 0.0 107.45 -178.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.41 ' H ' HD12 ' A' ' 110' ' ' LEU . 90.8 mm-40 52.9 -12.82 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.473 1.909 . . . . 0.0 115.364 -162.048 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 59.9 m -144.37 156.81 44.4 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 122.346 2.339 . . . . 0.0 109.604 175.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 107' ' ' ALA . 6.9 p -146.89 106.95 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 C-N-CA 124.892 1.277 . . . . 0.0 111.442 -175.297 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -78.47 108.27 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 176.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 27.0 mt -95.49 126.01 48.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 125.339 1.456 . . . . 0.0 108.258 174.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -123.81 101.73 7.43 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 126.071 1.749 . . . . 0.0 106.709 -173.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.47 ' HB3' HG23 ' A' ' 82' ' ' ILE . 27.6 p90 -116.96 166.49 12.12 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.161 -0.962 . . . . 0.0 111.746 -176.119 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -147.88 169.08 20.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.094 1.358 . . . . 0.0 109.339 173.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.7 p -108.98 -2.67 18.08 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.046 2.539 . . . . 0.0 111.171 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -135.38 131.8 36.78 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 124.407 1.083 . . . . 0.0 108.871 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -23.89 40.48 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -97.78 -0.03 46.03 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 116.354 1.983 . . . . 0.0 116.354 -167.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.7 p -116.48 167.16 11.3 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -165.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -72.5 152.96 41.6 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.486 -0.759 . . . . 0.0 109.408 176.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -87.9 162.75 16.74 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.77 0.828 . . . . 0.0 111.567 -167.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -73.44 -173.85 1.51 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.882 1.673 . . . . 0.0 108.989 166.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.0 93.91 2.56 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.081 0.952 . . . . 0.0 111.053 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.565 ' HE3' HD11 ' A' ' 108' ' ' LEU . 29.9 tptt -103.2 150.3 23.82 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 163.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.4 ' HA ' ' O ' ' A' ' 91' ' ' VAL . . . -140.88 125.82 18.23 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 115.708 -2.091 . . . . 0.0 107.159 175.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.565 HD11 ' HE3' ' A' ' 106' ' ' LYS . 1.1 mm? -121.8 158.63 28.44 Favored 'General case' 0 CA--C 1.499 -1.015 0 CA-C-N 122.114 2.233 . . . . 0.0 108.316 -177.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 68.7 p -74.08 156.56 37.31 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 119.891 1.223 . . . . 0.0 109.365 166.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.41 HD12 ' H ' ' A' ' 89' ' ' GLN . 34.5 mt -59.33 -36.1 75.06 Favored 'General case' 0 C--N 1.34 0.154 0 O-C-N 121.441 -0.787 . . . . 0.0 110.079 167.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.86 -36.44 82.32 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.799 -177.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.31 -59.05 4.64 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 124.062 0.945 . . . . 0.0 109.137 171.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.604 ' HB3' HD23 ' A' ' 31' ' ' LEU . 2.6 mm? -56.14 -40.03 73.17 Favored 'General case' 0 C--N 1.339 0.125 0 C-N-CA 123.09 0.556 . . . . 0.0 112.071 -175.129 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -63.58 -45.35 90.81 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 121.784 -0.573 . . . . 0.0 110.009 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -35.06 74.45 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.242 -0.409 . . . . 0.0 110.436 -177.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.46 -58.84 4.03 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.373 0.669 . . . . 0.0 109.241 177.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.447 ' CE2' ' HB2' ' A' ' 35' ' ' ALA . 6.6 m-85 -134.26 19.17 3.7 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -161.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.538 ' HB2' HD21 ' A' ' 31' ' ' LEU . 0.5 OUTLIER -141.01 66.34 1.37 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.268 1.395 . . . . 0.0 112.867 171.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -119.32 -25.54 6.07 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 -167.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.2 t -139.66 152.59 46.86 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 120.423 1.465 . . . . 0.0 108.644 -172.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -58.85 -30.51 67.76 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 119.916 -1.74 . . . . 0.0 113.202 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 65.5 m -53.05 -48.3 67.77 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 118.637 -0.697 . . . . 0.0 110.388 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.38 -33.03 64.81 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 117.169 -1.812 . . . . 0.0 107.88 -178.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 124' ' ' LYS . 35.2 mtpt -62.94 -3.39 1.6 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 114.22 1.193 . . . . 0.0 114.22 174.442 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -76.55 -81.89 0.08 Allowed 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 105.35 -2.093 . . . . 0.0 105.35 155.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.64 -49.57 76.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -163.193 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.48 ' HA ' ' CD2' ' A' ' 130' ' ' TYR . 38.3 t -56.86 -38.24 58.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 125.346 1.458 . . . . 0.0 110.722 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.62 -32.88 47.66 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.396 -0.815 . . . . 0.0 110.871 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -69.15 -31.38 70.0 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 120.899 -1.125 . . . . 0.0 111.461 175.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' TYR . . . . . 0.48 ' CD2' ' HA ' ' A' ' 127' ' ' VAL . 14.7 m-85 -63.06 -24.68 68.02 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 120.496 -1.378 . . . . 0.0 111.237 172.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 40.3 t -78.19 -11.99 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 122.942 0.497 . . . . 0.0 110.445 174.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -104.71 -17.01 14.79 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.423 1.089 . . . . 0.0 111.972 172.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -96.91 17.94 58.39 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 125.762 1.648 . . . . 0.0 113.026 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.0 pp -106.45 149.08 27.41 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 122.18 0.99 . . . . 0.0 110.275 177.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.409 ' HB3' HG23 ' A' ' 51' ' ' VAL . 5.1 mtt-85 -75.61 169.33 18.32 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.185 2.194 . . . . 0.0 107.83 163.091 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.22 -3.84 2.42 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.328 1.051 . . . . 0.0 113.014 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 C--O 1.245 0.847 0 C-N-CA 131.162 3.785 . . . . 0.0 107.145 177.196 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 . . . . . 0 CA--C 1.55 0.958 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -141.2 144.68 34.9 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 129.223 3.009 . . . . 0.0 106.438 174.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -53.01 -43.57 66.6 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 120.174 1.352 . . . . 0.0 110.531 -174.089 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -45.13 -54.22 7.09 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.065 1.746 . . . . 0.0 110.942 174.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.8 mm-40 -68.35 -36.9 79.93 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.675 1.19 . . . . 0.0 111.496 -177.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.402 HD13 ' HB3' ' A' ' 86' ' ' ALA . 97.9 mt -71.8 -39.92 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.066 0 C-N-CA 123.632 0.773 . . . . 0.0 109.39 -173.347 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.13 -35.55 92.13 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-N 118.828 0.74 . . . . 0.0 112.199 -175.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.6 -45.33 98.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 118.303 1.051 . . . . 0.0 109.534 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.62 -38.47 90.35 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.981 0.912 . . . . 0.0 110.711 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.95 -41.03 83.11 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.707 0.803 . . . . 0.0 111.188 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.71 -33.44 71.35 Favored Glycine 0 CA--C 1.528 0.87 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 176.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.57 -30.25 71.39 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 120.639 -1.507 . . . . 0.0 111.38 172.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.31 64.43 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 117.683 -1.151 . . . . 0.0 112.189 172.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -135.56 96.71 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 C-N-CA 125.375 1.47 . . . . 0.0 107.885 -165.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 60.98 67.41 1.46 Allowed Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.524 1.13 . . . . 0.0 109.762 -177.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -60.29 -33.88 94.18 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.734 2.289 . . . . 0.0 110.866 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -70.37 -39.64 74.48 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.66 -0.65 . . . . 0.0 111.955 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.1 t90 -56.97 -53.23 60.42 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.131 0.878 . . . . 0.0 108.859 174.2 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -46.4 -57.14 4.93 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.437 1.495 . . . . 0.0 109.329 173.276 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.1 mtpt -61.68 -41.08 97.08 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.464 1.106 . . . . 0.0 112.27 -175.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -67.55 -48.09 67.97 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.46 1.027 . . . . 0.0 109.562 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -42.03 81.05 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.801 0.441 . . . . 0.0 110.2 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.2 mm -60.52 -54.9 28.74 Favored 'Isoleucine or valine' 0 C--N 1.341 0.236 0 C-N-CA 124.438 1.095 . . . . 0.0 110.132 174.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.75 -42.85 65.33 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.352 0.661 . . . . 0.0 110.691 -175.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.23 -8.44 53.61 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 50.34 40.66 23.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.946 1.698 . . . . 0.0 110.979 -165.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -111.64 -5.57 14.48 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.871 0.868 . . . . 0.0 113.337 178.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.0 tp -73.63 128.7 36.21 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 119.172 0.896 . . . . 0.0 109.643 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.8 t -113.54 150.18 15.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 169.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -120.02 149.18 42.58 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 128.067 2.547 . . . . 0.0 106.908 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -163.7 177.21 39.64 Favored Glycine 0 N--CA 1.45 -0.413 0 N-CA-C 111.581 -0.607 . . . . 0.0 111.581 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.6 mm -106.45 149.24 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 125.375 1.47 . . . . 0.0 107.055 168.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.78 HG13 HG11 ' A' ' 61' ' ' VAL . 24.7 t -52.4 -86.02 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-O 116.866 -1.54 . . . . 0.0 110.627 172.549 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.408 ' N ' HG12 ' A' ' 55' ' ' VAL . 55.3 mmtt 55.44 164.99 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.925 0 CA-C-N 120.408 1.458 . . . . 0.0 112.956 -167.332 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -84.12 -3.36 10.29 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.36 2.707 . . . . 0.0 114.632 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.5 m -59.36 -24.16 63.16 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.369 1.068 . . . . 0.0 113.409 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.16 165.75 17.68 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 128.982 2.913 . . . . 0.0 108.103 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.4 t -65.64 146.69 54.5 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 121.781 -0.574 . . . . 0.0 109.568 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.78 HG11 HG13 ' A' ' 55' ' ' VAL . 1.9 m -153.55 162.36 26.82 Favored Pre-proline 0 C--O 1.237 0.413 0 C-N-CA 125.73 1.612 . . . . 0.0 108.865 174.583 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -75.71 167.82 25.59 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.798 2.332 . . . . 0.0 110.423 171.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.68 139.81 51.32 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 123.62 0.768 . . . . 0.0 109.996 171.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.54 39.45 5.01 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 125.797 1.665 . . . . 0.0 112.842 169.046 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.3 m -152.2 27.79 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 125.454 1.501 . . . . 0.0 111.143 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -65.75 -16.19 63.54 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -151.295 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -153.07 52.06 0.74 Allowed 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 128.547 2.739 . . . . 0.0 106.542 169.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -89.46 154.89 19.68 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 164.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.63 162.14 28.51 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 164.201 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -141.3 170.76 15.12 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.539 1.136 . . . . 0.0 109.757 166.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 18.7 mt -141.22 138.66 33.46 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 126.461 1.904 . . . . 0.0 107.176 174.106 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.516 HG21 HH21 ' A' ' 99' ' ' ARG . 10.8 p -162.4 155.82 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 125.636 1.574 . . . . 0.0 107.571 177.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.04 158.18 30.7 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 119.724 1.147 . . . . 0.0 108.97 170.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.26 -21.23 66.11 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 177.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -100.01 -32.01 11.17 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.11 0.964 . . . . 0.0 111.305 176.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.08 13.84 0.19 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.551 2.341 . . . . 0.0 112.076 -178.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -59.5 -12.33 6.13 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.95 1.7 . . . . 0.0 113.793 -171.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.59 -2.83 9.36 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.923 0.889 . . . . 0.0 112.119 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.02 -87.92 1.72 Allowed Glycine 0 CA--C 1.526 0.764 0 C-N-CA 124.405 1.002 . . . . 0.0 112.483 -174.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 m -103.62 166.96 10.1 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.709 1.204 . . . . 0.0 109.298 -174.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.3 tt -166.65 151.24 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 124.64 1.176 . . . . 0.0 107.983 165.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.555 HG23 ' HB3' ' A' ' 95' ' ' TYR . 10.9 mt -134.6 99.19 2.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -78.6 153.04 31.46 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -157.9 158.96 36.04 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.491 -0.755 . . . . 0.0 109.333 167.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.435 ' HA ' ' HE3' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -143.02 106.89 4.66 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 167.805 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.402 ' HB3' HD13 ' A' ' 28' ' ' ILE . . . -82.69 147.61 28.39 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 168.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -147.57 -153.74 0.51 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 126.127 1.771 . . . . 0.0 107.911 -167.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.93 88.89 0.01 OUTLIER Glycine 0 CA--C 1.527 0.795 0 C-N-CA 125.815 1.674 . . . . 0.0 111.432 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 53.88 8.72 0.17 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.554 2.342 . . . . 0.0 115.491 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.6 m -125.35 163.48 22.49 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.554 1.942 . . . . 0.0 108.124 -175.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 7.7 p -151.19 106.37 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -0.99 0 C-N-CA 125.158 1.383 . . . . 0.0 111.865 174.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.457 HD12 ' H ' ' A' ' 92' ' ' ILE . 3.9 mp -74.41 96.65 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 172.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 15.3 mt -77.8 127.56 38.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 105.991 -1.855 . . . . 0.0 105.991 163.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -127.11 97.14 4.83 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 125.389 1.475 . . . . 0.0 107.343 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.555 ' HB3' HG23 ' A' ' 82' ' ' ILE . 47.7 p90 -124.03 167.6 13.97 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.018 -1.051 . . . . 0.0 109.69 -173.483 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . 0.3 9.8 t -131.68 -163.71 1.36 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.83 0.824 . . . . 0.0 109.557 -166.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 p -122.59 -1.63 9.0 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 120.874 -1.141 . . . . 0.0 111.209 152.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -153.48 145.44 23.62 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 124.606 1.163 . . . . 0.0 111.697 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.516 HH21 HG21 ' A' ' 72' ' ' VAL . 11.1 mmt180 -52.13 -33.75 41.35 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 167.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -79.71 -5.22 54.79 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 -173.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -133.11 163.93 28.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -168.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.496 ' HD2' ' H ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -69.45 164.02 24.0 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.553 1.168 . . . . 0.0 111.452 -164.866 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.496 ' H ' ' HD2' ' A' ' 102' ' ' LYS . 1.3 mm? -94.9 138.3 32.83 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.99 -1.005 . . . . 0.0 108.707 -174.142 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 7.8 mptt -60.38 169.18 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.627 1.171 . . . . 0.0 109.86 161.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -127.07 90.62 3.18 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.765 1.226 . . . . 0.0 109.849 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.71 83.66 1.88 Allowed 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 171.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.43 138.65 47.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 117.241 -1.361 . . . . 0.0 107.334 168.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.0 mt -133.79 -177.45 4.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 120.693 1.588 . . . . 0.0 106.795 171.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 62.1 p -101.13 155.73 17.83 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.666 0.746 . . . . 0.0 110.467 172.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 21.7 mt -59.83 -16.67 30.32 Favored 'General case' 0 C--O 1.237 0.435 0 O-C-N 121.641 -0.662 . . . . 0.0 112.238 166.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.16 -50.95 10.18 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 117.561 -1.209 . . . . 0.0 109.5 172.045 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -44.95 -61.27 1.68 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 124.403 1.081 . . . . 0.0 109.517 176.788 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.4 -36.93 74.31 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.214 0.916 . . . . 0.0 112.052 -168.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -65.2 -45.01 86.54 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.522 -0.736 . . . . 0.0 110.417 173.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.27 -2.01 26.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.868 2.067 . . . . 0.0 113.505 177.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -105.95 -46.57 4.07 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.067 1.747 . . . . 0.0 109.69 179.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -139.16 16.9 2.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.373 1.069 . . . . 0.0 113.248 -166.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -139.68 14.86 2.52 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 120.862 -1.149 . . . . 0.0 113.331 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLN . . . . . 0.44 ' CD ' ' H ' ' A' ' 119' ' ' GLN . 2.2 pm0 -58.2 -64.15 1.02 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 9.6 p -73.37 179.56 3.92 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.914 0.779 . . . . 0.0 111.286 -168.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 36.2 mtt85 -81.51 -55.85 4.41 Favored 'General case' 0 CA--C 1.507 -0.696 0 O-C-N 121.46 -0.775 . . . . 0.0 111.642 170.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 11.5 m -66.13 -26.99 67.7 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.191 -168.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -55.64 -37.77 68.64 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.159 0.584 . . . . 0.0 111.015 173.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.4 mtpt -62.2 -28.43 69.67 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 118.157 -0.925 . . . . 0.0 110.71 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -63.86 -51.76 63.15 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.89 -57.31 9.15 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 123.6 0.76 . . . . 0.0 110.978 178.343 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 65.9 t -51.23 -51.14 24.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -73.78 -24.83 59.89 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.8 0.727 . . . . 0.0 112.555 -176.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -61.04 -48.02 83.67 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.926 0.89 . . . . 0.0 109.274 166.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 7.7 m-30 -61.28 -41.02 96.25 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.875 0.87 . . . . 0.0 109.719 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.0 t -64.17 -22.56 31.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 O-C-N 121.14 -0.975 . . . . 0.0 110.837 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -104.08 -13.94 16.09 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 119.842 1.201 . . . . 0.0 113.075 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.98 -27.17 58.85 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 124.459 1.028 . . . . 0.0 110.686 174.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.5 pp -73.42 147.29 44.37 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 118.3 1.05 . . . . 0.0 110.282 175.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -105.83 167.03 10.06 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.474 1.51 . . . . 0.0 107.785 -177.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.7 m -126.34 3.06 7.02 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.438 1.017 . . . . 0.0 111.431 175.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.149 0 C-N-CA 127.509 2.324 . . . . 0.0 107.181 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 . . . . . 0 CA--C 1.543 0.705 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.0 p -141.52 153.49 44.92 Favored 'General case' 0 N--CA 1.463 0.209 0 O-C-N 120.46 -1.4 . . . . 0.0 111.245 -177.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -61.21 -39.0 88.58 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.494 0.717 . . . . 0.0 110.846 -167.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -49.88 70.68 Favored 'General case' 0 C--N 1.341 0.196 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -177.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 60.9 mm-40 -60.81 -47.44 86.35 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.998 1.319 . . . . 0.0 109.29 -177.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 84.5 mt -61.34 -38.5 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 123.433 0.693 . . . . 0.0 110.242 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.64 -19.67 73.26 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 119.136 -0.813 . . . . 0.0 113.636 -178.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.9 t -70.53 -52.66 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 170.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.83 -36.29 83.44 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 122.297 -0.252 . . . . 0.0 110.755 -176.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.63 -49.67 69.98 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.424 0.69 . . . . 0.0 111.622 171.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.93 -34.3 88.14 Favored Glycine 0 CA--C 1.529 0.935 0 CA-C-O 119.56 -0.578 . . . . 0.0 111.726 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.19 -27.51 68.74 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.412 1.606 . . . . 0.0 112.041 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.36 -14.56 60.08 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.089 -1.007 . . . . 0.0 112.653 172.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.422 HD12 ' CE1' ' A' ' 95' ' ' TYR . 45.2 mm -136.43 89.65 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 124.947 1.299 . . . . 0.0 107.583 -167.045 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.65 60.49 1.42 Allowed Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.652 1.181 . . . . 0.0 110.376 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -58.28 -33.86 98.07 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.286 2.658 . . . . 0.0 112.511 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.61 -34.71 78.9 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.083 0.553 . . . . 0.0 111.762 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -64.94 -55.92 16.3 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 175.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.2 tt -49.15 -50.3 38.29 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.903 0.481 . . . . 0.0 110.055 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -55.56 -54.23 46.58 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.439 1.096 . . . . 0.0 112.041 177.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -56.82 -42.18 79.14 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.675 0.671 . . . . 0.0 111.689 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -65.02 -53.04 52.3 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.334 1.053 . . . . 0.0 109.992 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 mm -58.61 -40.88 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 C-N-CA 124.555 1.142 . . . . 0.0 109.78 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.17 -8.44 17.12 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.648 0.779 . . . . 0.0 112.802 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -121.36 5.86 10.18 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.013 1.725 . . . . 0.0 111.87 175.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 44.95 33.16 0.95 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.516 1.927 . . . . 0.0 111.825 -168.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -98.96 43.48 1.06 Allowed 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 176.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -134.52 142.46 47.02 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.572 1.078 . . . . 0.0 108.284 172.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.755 HG23 ' HB3' ' A' ' 135' ' ' ARG . 2.8 p -126.53 165.84 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 C-N-CA 126.651 1.98 . . . . 0.0 110.579 175.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -131.62 120.19 22.49 Favored 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 103.232 -2.877 . . . . 0.0 103.232 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -135.46 -178.98 16.11 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mm -122.39 144.54 31.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 C-N-CA 125.631 1.572 . . . . 0.0 107.545 172.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.7 t -45.85 -75.19 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 C-N-CA 128.481 2.713 . . . . 0.0 111.958 174.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.408 ' HB3' ' HD2' ' A' ' 57' ' ' PRO . 19.4 mmtp 57.3 166.61 0.07 OUTLIER Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 119.543 1.065 . . . . 0.0 111.326 -166.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 56' ' ' LYS . 96.1 Cg_endo -79.07 -4.06 13.61 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.29 1.993 . . . . 0.0 112.299 -178.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.7 p -58.31 -78.86 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 128.673 2.789 . . . . 0.0 111.808 -171.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.47 153.38 28.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.31 121.09 16.18 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.051 1.34 . . . . 0.0 109.048 -169.7 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.1 m -135.36 160.92 66.18 Favored Pre-proline 0 C--O 1.24 0.601 0 C-N-CA 123.962 0.905 . . . . 0.0 110.241 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.46 171.37 13.1 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.335 2.023 . . . . 0.0 110.603 170.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.37 151.4 34.88 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.425 171.12 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.9 47.82 11.02 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 124.653 1.121 . . . . 0.0 111.122 174.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.6 m -151.4 26.28 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 125.796 1.638 . . . . 0.0 110.15 170.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -61.75 -16.9 53.4 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.577 2.066 . . . . 0.0 116.577 -151.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -144.71 14.34 1.55 Allowed 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 128.082 2.553 . . . . 0.0 111.445 -172.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -70.69 149.47 46.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.186 1.395 . . . . 0.0 109.666 -179.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.2 m -73.25 164.28 26.9 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.892 163.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -142.19 158.36 43.83 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.218 1.007 . . . . 0.0 109.947 166.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.71 136.29 54.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.577 1.551 . . . . 0.0 107.96 170.538 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.1 p -152.4 155.48 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-N 119.454 1.024 . . . . 0.0 109.524 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.45 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -90.1 121.77 32.46 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 120.109 1.322 . . . . 0.0 109.186 176.061 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.43 -10.16 41.17 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -166.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -117.39 2.89 12.52 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.838 1.255 . . . . 0.0 110.903 -178.089 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.45 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 22.5 t0 -135.55 38.53 2.87 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 128.86 2.864 . . . . 0.0 106.902 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -64.74 -12.88 51.91 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 120.653 -1.279 . . . . 0.0 113.271 -163.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -107.83 3.81 24.79 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 127.94 2.496 . . . . 0.0 112.346 177.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.36 -78.37 0.98 Allowed Glycine 0 C--N 1.336 0.535 0 N-CA-C 110.239 -1.144 . . . . 0.0 110.239 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 20.7 m -121.64 156.81 32.21 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.463 1.105 . . . . 0.0 109.817 -174.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.4 tt -152.39 152.88 10.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.525 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 163.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 80.4 mt -133.59 117.79 28.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 172.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -84.17 153.87 23.42 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 170.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.7 p90 -155.34 162.85 40.73 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 120.924 -1.11 . . . . 0.0 110.265 165.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -145.12 129.11 17.48 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 117.971 0.35 . . . . 0.0 111.031 162.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HA ' HG22 ' A' ' 91' ' ' VAL . . . -71.32 118.65 14.38 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.707 0.803 . . . . 0.0 109.865 164.073 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -131.23 76.01 1.69 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.752 2.421 . . . . 0.0 106.138 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.16 -129.46 9.68 Favored Glycine 0 C--N 1.338 0.686 0 C-N-CA 124.684 1.135 . . . . 0.0 112.142 174.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -88.45 22.29 2.59 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.107 1.453 . . . . 0.0 112.129 170.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 93.9 m -137.16 148.37 46.55 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.945 1.698 . . . . 0.0 108.082 176.068 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.415 HG22 ' HA ' ' A' ' 86' ' ' ALA . 61.5 t -118.76 129.03 75.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 167.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 19.8 mm -91.39 108.32 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 105.009 -2.219 . . . . 0.0 105.009 169.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.402 HG21 HG13 ' A' ' 36' ' ' ILE . 8.8 mt -89.85 141.96 13.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 173.155 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.445 ' HB3' HD13 ' A' ' 103' ' ' LEU . 68.2 mttt -136.34 100.43 4.38 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 125.473 1.509 . . . . 0.0 108.17 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.422 ' CE1' HD12 ' A' ' 36' ' ' ILE . 34.9 p90 -115.6 165.89 12.52 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 122.75 0.42 . . . . 0.0 111.034 -174.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.505 HG23 ' O ' ' A' ' 98' ' ' GLN . 9.2 t -146.51 171.76 14.58 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 125.801 1.64 . . . . 0.0 107.573 172.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 53.0 p -106.45 19.7 20.11 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.399 1.479 . . . . 0.0 110.253 169.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLN . . . . . 0.505 ' O ' HG23 ' A' ' 96' ' ' THR . 8.0 mm-40 -127.91 -171.46 2.45 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.775 0.83 . . . . 0.0 109.217 167.165 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.71 -25.56 23.4 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 169.254 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.7 p30 -142.65 15.76 1.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -149.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.9 p -119.03 -179.92 3.97 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 119.754 1.161 . . . . 0.0 113.762 -170.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -53.22 125.4 17.43 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 123.666 0.786 . . . . 0.0 110.099 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 94' ' ' LYS . 58.6 mt -79.61 159.56 26.74 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 125.59 1.556 . . . . 0.0 109.043 -179.033 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -82.08 177.4 8.84 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 125.162 1.385 . . . . 0.0 110.162 171.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.37 119.76 35.57 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.256 1.422 . . . . 0.0 109.948 171.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.3 tptt -144.83 132.62 21.17 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 170.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -138.85 105.45 5.33 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 106.195 -1.779 . . . . 0.0 106.195 -171.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -118.22 145.44 44.99 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -174.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 37.4 p -75.02 153.05 38.66 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.332 0.515 . . . . 0.0 111.917 176.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.3 mt -60.5 -23.94 64.92 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 121.814 -0.554 . . . . 0.0 110.515 168.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.94 -46.41 71.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.321 172.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -51.41 -65.39 0.56 Allowed 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.462 1.105 . . . . 0.0 110.304 176.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.74 -34.87 73.51 Favored 'General case' 0 CA--C 1.521 -0.137 0 C-N-CA 122.781 0.432 . . . . 0.0 111.878 -170.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -69.74 -34.03 73.27 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.906 -0.496 . . . . 0.0 109.834 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -53.92 12.29 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.982 174.337 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -53.43 -56.74 14.37 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.14 0.976 . . . . 0.0 110.706 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -124.09 11.62 8.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.167 0.987 . . . . 0.0 113.171 -160.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -143.99 23.46 1.7 Allowed 'General case' 0 CA--C 1.537 0.454 0 O-C-N 120.525 -1.359 . . . . 0.0 114.475 175.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -69.53 -40.29 76.99 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 120.27 -1.519 . . . . 0.0 114.418 -171.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.8 t -107.05 173.57 6.27 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 126.369 1.868 . . . . 0.0 109.048 -163.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 2.2 mtm-85 -79.65 -47.85 14.71 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 124.104 0.961 . . . . 0.0 112.593 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.0 m -57.42 -37.61 73.03 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.731 0.645 . . . . 0.0 110.519 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -62.33 -29.79 70.7 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.454 -0.779 . . . . 0.0 111.796 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 29.4 mtpt -65.68 -33.49 76.01 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 118.047 -0.977 . . . . 0.0 109.801 -178.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -49.38 78.04 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 176.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -69.63 -56.84 6.14 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 118.633 -0.698 . . . . 0.0 110.202 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 53.5 t -49.32 -53.31 9.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 123.882 0.873 . . . . 0.0 110.826 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -71.59 -17.56 62.28 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.731 0.696 . . . . 0.0 112.043 -177.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -80.7 -29.94 36.44 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.24 -0.912 . . . . 0.0 111.126 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -64.37 -36.64 84.79 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 167.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 26.1 t -64.68 -23.47 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 121.04 -1.038 . . . . 0.0 110.653 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -89.73 15.32 9.87 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.782 -1.199 . . . . 0.0 112.25 174.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -136.23 9.31 4.12 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 124.693 1.139 . . . . 0.0 114.258 -174.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.2 22.88 11.93 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -161.128 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.755 ' HB3' HG23 ' A' ' 51' ' ' VAL . 19.2 mtt180 44.26 -164.04 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 130.675 3.59 . . . . 0.0 110.773 179.289 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.36 -5.12 0.39 Allowed 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 118.892 -1.123 . . . . 0.0 112.685 159.115 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 . . . . . 0 C--O 1.254 1.322 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 -173.016 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 . . . . . 0 CA--C 1.534 0.328 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.0 p -120.26 170.68 9.11 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 165.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -62.65 -43.53 98.58 Favored 'General case' 0 C--O 1.233 0.22 0 O-C-N 121.743 -0.598 . . . . 0.0 110.078 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -48.83 80.06 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 123.987 0.915 . . . . 0.0 109.977 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.8 mm-40 -55.55 -47.36 76.46 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 125.49 1.516 . . . . 0.0 110.391 -175.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.4 mt -64.15 -33.41 62.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -178.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -65.88 -30.84 77.95 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-O 118.957 -0.913 . . . . 0.0 113.871 178.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.446 HG21 HG22 ' A' ' 131' ' ' VAL . 61.6 t -75.89 -44.75 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mp -55.42 -45.46 76.75 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.008 0.523 . . . . 0.0 110.449 173.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.46 -42.46 96.21 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.942 0.497 . . . . 0.0 111.672 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.33 -20.75 79.55 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 112.115 -0.394 . . . . 0.0 112.115 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.6 mp -69.77 -26.87 64.5 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.985 -1.303 . . . . 0.0 111.803 173.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.428 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -80.88 -27.56 36.26 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 171.431 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.428 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.3 mp -127.08 95.18 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -174.021 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m 67.51 63.5 0.73 Allowed Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.398 1.479 . . . . 0.0 113.009 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.94 -42.4 37.56 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.243 2.628 . . . . 0.0 111.721 176.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.12 -42.71 75.7 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.408 -0.807 . . . . 0.0 110.563 -173.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' TRP . . . . . 0.463 ' HA ' ' HG2' ' A' ' 43' ' ' GLN . 37.6 t90 -60.04 -37.58 80.21 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.087 0.555 . . . . 0.0 111.604 175.01 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.31 -63.32 1.34 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 172.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -55.13 -36.83 66.17 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 123.585 0.754 . . . . 0.0 112.286 -173.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.463 ' HG2' ' HA ' ' A' ' 40' ' ' TRP 0.252 1.5 pt20 -64.59 -45.15 88.2 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 118.193 0.452 . . . . 0.0 111.166 -176.32 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -69.06 -34.16 74.73 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 124.157 0.983 . . . . 0.0 110.616 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.7 mm -58.87 -45.18 91.82 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.494 166.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.03 -4.3 4.54 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -177.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.57 10.08 7.19 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.276 1.03 . . . . 0.0 111.658 170.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 49.14 31.29 3.42 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.439 2.295 . . . . 0.0 113.111 -173.312 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -91.13 3.37 54.95 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.196 1.799 . . . . 0.0 115.657 -174.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.457 HD21 HD22 ' A' ' 71' ' ' LEU . 55.5 tp -87.47 139.53 30.45 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.099 1.318 . . . . 0.0 110.758 -177.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 71.8 t -114.33 123.62 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 C-N-CA 124.856 1.263 . . . . 0.0 107.69 165.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -71.93 135.16 46.4 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.269 1.428 . . . . 0.0 107.791 156.303 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -147.24 167.59 28.44 Favored Glycine 0 C--N 1.333 0.406 0 CA-C-N 118.633 0.652 . . . . 0.0 112.281 175.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 20.0 mm -117.49 134.38 61.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 106.153 -1.795 . . . . 0.0 106.153 173.235 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.668 HG13 HG11 ' A' ' 61' ' ' VAL . 28.8 t -47.91 -71.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 C-N-CA 128.194 2.597 . . . . 0.0 110.089 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 21.2 mttt 58.65 159.03 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.517 0 C-N-CA 127.115 2.166 . . . . 0.0 113.276 -166.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.69 -12.32 30.95 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 121.872 1.715 . . . . 0.0 111.732 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -60.87 -14.18 20.43 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.214 1.405 . . . . 0.0 112.509 175.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -131.38 -173.53 3.14 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 120.237 1.381 . . . . 0.0 112.264 -173.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 24.6 m -129.2 101.69 6.13 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.744 1.218 . . . . 0.0 107.803 -149.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.668 HG11 HG13 ' A' ' 55' ' ' VAL . 4.9 m -142.96 157.19 61.49 Favored Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 124.977 1.311 . . . . 0.0 110.859 -154.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -67.24 172.04 10.63 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 122.279 1.986 . . . . 0.0 111.573 175.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.52 141.33 57.91 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.775 0.83 . . . . 0.0 111.366 176.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.61 43.16 45.0 Favored Glycine 0 CA--C 1.485 -1.791 0 C-N-CA 124.299 0.952 . . . . 0.0 113.234 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.683 HG23 ' HB2' ' A' ' 68' ' ' TYR 0.252 1.6 p -170.37 80.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.416 -2.135 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 177.981 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -98.82 -6.64 28.82 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.015 -1.448 . . . . 0.0 112.235 162.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -152.4 -1.64 0.27 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -168.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.683 ' HB2' HG23 ' A' ' 65' ' ' VAL . 3.3 m-85 -67.92 115.66 7.69 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 119.657 1.117 . . . . 0.0 108.343 178.208 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -53.8 139.16 33.98 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.777 1.231 . . . . 0.0 109.948 -177.049 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 22.3 p90 -122.38 167.15 13.64 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.353 0.661 . . . . 0.0 112.665 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.457 HD22 HD21 ' A' ' 50' ' ' LEU . 54.0 mt -143.22 125.71 15.77 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 127.336 2.254 . . . . 0.0 106.47 -174.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.6 p -157.39 155.52 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 125.144 1.378 . . . . 0.0 108.397 -178.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.87 157.17 16.92 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.416 1.007 . . . . 0.0 110.422 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.01 -25.62 63.82 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 -166.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -106.71 -8.65 16.77 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 124.549 1.14 . . . . 0.0 112.339 -174.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.6 p30 -123.48 32.55 5.6 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.905 0.882 . . . . 0.0 109.233 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -51.72 -22.42 3.5 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.197 0.999 . . . . 0.0 113.556 173.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -116.47 6.43 13.57 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.77 1.628 . . . . 0.0 112.877 175.055 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.82 -126.13 1.75 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 126.39 1.948 . . . . 0.0 110.553 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.0 m -64.2 160.1 19.24 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 170.458 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.2 tt -157.46 147.8 10.24 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 160.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 88.9 mt -126.99 135.46 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -119.61 157.14 29.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 126.012 1.725 . . . . 0.0 106.983 176.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -159.72 153.81 23.4 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 120.425 -1.422 . . . . 0.0 108.906 172.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.79 110.68 13.36 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 166.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.74 84.32 0.9 Allowed 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 161.65 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -75.96 -169.53 1.14 Allowed 'General case' 0 C--O 1.24 0.555 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.62 104.56 0.39 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 124.19 0.9 . . . . 0.0 111.007 178.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 62.55 14.72 7.3 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.323 1.449 . . . . 0.0 111.614 168.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.0 m -144.44 138.96 28.06 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.571 1.948 . . . . 0.0 107.985 -172.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 18.5 t -115.38 112.03 38.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 169.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.429 HD12 ' H ' ' A' ' 92' ' ' ILE . 4.2 mp -86.64 104.12 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 N-CA-C 105.726 -1.953 . . . . 0.0 105.726 166.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 mt -86.54 113.78 24.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -108.4 98.7 8.19 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 126.32 1.848 . . . . 0.0 108.63 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -124.25 165.89 16.85 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 119.925 -1.735 . . . . 0.0 110.533 -175.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.5 t -154.22 171.27 19.47 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.635 1.574 . . . . 0.0 108.774 -177.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.5 -11.74 19.07 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.651 1.58 . . . . 0.0 111.288 174.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -147.6 145.51 29.03 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.15 176.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.0 tpt85 -53.8 -41.35 67.2 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.139 0.976 . . . . 0.0 109.796 173.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 39.4 p30 -78.56 26.68 0.22 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.489 1.515 . . . . 0.0 114.94 176.382 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.95 158.6 43.9 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 119.753 -1.842 . . . . 0.0 112.131 172.333 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 103' ' ' LEU . 3.4 tptm -63.29 166.68 6.02 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 124.397 1.079 . . . . 0.0 109.616 169.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.416 ' H ' ' HG3' ' A' ' 102' ' ' LYS . 26.5 mt -105.88 156.52 18.27 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 125.822 1.649 . . . . 0.0 108.613 -172.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -71.79 -179.28 2.59 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.652 1.181 . . . . 0.0 109.563 165.168 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -142.99 70.84 1.33 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.18 0.992 . . . . 0.0 108.647 167.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -70.64 101.14 1.98 Allowed 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 170.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -95.3 136.29 35.84 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 175.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 29.1 mt -146.89 153.95 40.73 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.391 1.876 . . . . 0.0 106.334 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 11.9 p -76.53 154.8 34.25 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.501 -0.749 . . . . 0.0 111.2 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 11.8 mt -59.96 -25.52 65.26 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.188 -0.945 . . . . 0.0 110.531 169.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.23 -46.29 70.91 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 117.264 -1.35 . . . . 0.0 112.607 170.632 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.95 -60.19 2.4 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.067 1.347 . . . . 0.0 110.079 177.471 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.17 -42.22 85.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.345 1.458 . . . . 0.0 110.54 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -66.44 -34.07 77.12 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.471 -0.768 . . . . 0.0 110.257 -178.373 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.15 -66.58 0.54 Allowed 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 175.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -49.74 -42.15 45.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 126.584 1.954 . . . . 0.0 114.333 -166.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -128.1 18.51 6.56 Favored 'General case' 0 C--O 1.226 -0.146 0 CA-C-N 118.181 0.446 . . . . 0.0 111.636 -173.823 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -142.71 17.17 1.99 Allowed 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.631 -0.668 . . . . 0.0 111.359 177.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -51.05 -74.13 0.03 OUTLIER 'General case' 0 C--N 1.351 0.663 0 CA-C-N 119.313 0.961 . . . . 0.0 111.801 165.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.64 151.04 27.8 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 -169.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 62.5 ttt-85 -75.86 -21.43 57.22 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-O 117.702 -1.142 . . . . 0.0 112.382 173.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 1.4 t -59.66 -50.25 74.6 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 119.933 1.242 . . . . 0.0 108.179 175.674 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -61.65 -24.89 67.02 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.229 0.468 . . . . 0.0 111.917 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -69.93 -5.19 24.36 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 118.031 -0.985 . . . . 0.0 112.677 176.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? -70.97 -75.54 0.12 Allowed 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 155.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -55.57 -47.3 76.64 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -162.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 71.2 t -55.1 -51.36 55.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 125.091 1.356 . . . . 0.0 110.194 177.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.17 -27.42 60.81 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.93 0.892 . . . . 0.0 110.926 -177.155 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.61 -51.26 70.56 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.543 2.337 . . . . 0.0 108.542 169.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -57.31 -27.96 62.64 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.577 0.751 . . . . 0.0 111.394 -178.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.446 HG22 HG21 ' A' ' 30' ' ' VAL . 60.2 t -75.36 -25.62 18.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 O-C-N 121.205 -0.935 . . . . 0.0 112.171 177.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -90.8 -18.11 25.46 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.457 -0.777 . . . . 0.0 111.159 173.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.31 9.91 73.4 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.063 1.316 . . . . 0.0 114.658 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.424 ' HB3' HD23 ' A' ' 50' ' ' LEU . 3.8 pp -104.65 167.64 9.6 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.968 1.307 . . . . 0.0 111.667 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 49.8 mtp85 -109.53 176.71 4.98 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 125.47 1.508 . . . . 0.0 108.671 172.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.82 3.94 1.87 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.752 0.421 . . . . 0.0 111.216 -169.712 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 . . . . . 0 C--O 1.246 0.915 0 C-N-CA 129.113 2.965 . . . . 0.0 109.839 -158.987 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.24 0.583 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.15 137.71 54.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.508 1.523 . . . . 0.0 107.956 175.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -69.58 -40.09 76.94 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.757 -0.59 . . . . 0.0 110.282 -166.062 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -45.6 -51.05 12.62 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.37 1.468 . . . . 0.0 110.231 165.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -69.59 -37.39 76.9 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.561 1.144 . . . . 0.0 112.053 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.7 mt -62.52 -36.49 75.21 Favored 'Isoleucine or valine' 0 C--N 1.342 0.278 0 CA-C-N 120.499 1.5 . . . . 0.0 110.909 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -51.85 -48.13 51.83 Favored Glycine 0 C--N 1.336 0.571 0 CA-C-N 119.65 1.113 . . . . 0.0 112.827 -174.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.4 t -62.26 -46.23 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-N 117.226 0.513 . . . . 0.0 110.084 -178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.491 HD21 HG11 ' A' ' 127' ' ' VAL . 80.6 mt -70.68 -34.09 71.61 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.327 0.651 . . . . 0.0 111.436 -176.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.26 -48.46 78.08 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.04 0.936 . . . . 0.0 109.631 171.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.75 -34.62 78.15 Favored Glycine 0 C--N 1.336 0.578 0 N-CA-C 111.644 -0.582 . . . . 0.0 111.644 175.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.1 mt -63.78 -31.06 72.11 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 120.607 -1.525 . . . . 0.0 110.794 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.14 -19.14 57.27 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 117.592 -1.194 . . . . 0.0 113.252 172.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.0 mm -144.4 93.0 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 125.905 1.682 . . . . 0.0 108.085 -163.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t 56.27 71.66 1.15 Allowed Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 126.5 1.92 . . . . 0.0 111.629 -171.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -60.58 -42.88 36.42 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.447 2.098 . . . . 0.0 109.208 171.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.86 -56.23 13.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.195 1.398 . . . . 0.0 110.99 177.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 69.3 t90 -53.07 -53.21 53.66 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.543 0.61 . . . . 0.0 110.214 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.7 tt -59.1 -48.26 82.26 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 118.438 0.563 . . . . 0.0 110.678 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.0 mttm -56.0 -45.55 79.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 118.679 0.672 . . . . 0.0 110.589 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -69.3 -39.57 78.22 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -65.27 -46.84 78.85 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.391 -0.818 . . . . 0.0 111.257 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.6 mm -60.87 -35.29 63.71 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.114 0 C-N-CA 123.9 0.88 . . . . 0.0 110.416 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.48 -39.76 58.16 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.03 0.832 . . . . 0.0 111.319 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -100.98 6.23 43.45 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.013 1.725 . . . . 0.0 113.302 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 54.27 19.39 2.19 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.199 1.799 . . . . 0.0 112.147 -171.46 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -83.25 10.01 9.41 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 119.984 -1.698 . . . . 0.0 112.128 -178.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.4 tp -84.85 145.92 27.58 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 171.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' VAL . . . . . 0.579 HG23 ' CB ' ' A' ' 135' ' ' ARG . 3.5 p -128.45 165.52 27.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 125.119 1.368 . . . . 0.0 108.876 167.278 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -134.11 159.31 41.23 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 128.874 2.87 . . . . 0.0 105.801 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.59 175.51 43.98 Favored Glycine 0 CA--C 1.517 0.184 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 177.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 42.2 mm -113.8 134.68 55.84 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.715 0 C-N-CA 126.463 1.905 . . . . 0.0 106.589 178.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.525 HG12 HG11 ' A' ' 61' ' ' VAL . 0.4 OUTLIER -44.51 -82.96 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.421 -1.919 1 C-N-CA 132.063 4.145 . . . . 0.0 111.718 169.067 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.515 ' H ' HG23 ' A' ' 55' ' ' VAL . 15.1 mmtt 60.33 166.24 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 124.838 1.255 . . . . 0.0 112.551 -173.572 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -65.08 -6.91 13.94 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.341 2.027 . . . . 0.0 115.256 167.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.2 m -91.92 -48.52 6.72 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 120.086 1.312 . . . . 0.0 113.872 -166.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.73 169.89 16.41 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.385 0.993 . . . . 0.0 108.972 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.8 m -80.13 108.52 13.79 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 174.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.525 HG11 HG12 ' A' ' 55' ' ' VAL . 2.6 m -131.89 163.19 51.7 Favored Pre-proline 0 C--O 1.238 0.472 0 C-N-CA 125.292 1.437 . . . . 0.0 108.972 167.378 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -75.6 164.06 32.91 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 121.572 1.515 . . . . 0.0 111.695 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.13 123.43 15.24 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.332 169.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 105.35 26.92 6.03 Favored Glycine 0 CA--C 1.529 0.911 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.026 172.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.1 m -144.21 81.77 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.51 1.524 . . . . 0.0 108.478 172.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -89.85 -14.42 34.39 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.15 1.908 . . . . 0.0 116.15 -172.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -165.32 14.9 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 126.863 2.065 . . . . 0.0 110.599 -176.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.426 ' CG ' ' HB2' ' A' ' 85' ' ' LYS . 10.3 m-85 -77.13 110.12 11.55 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 175.748 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.3 m -49.99 139.05 14.5 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.36 0.664 . . . . 0.0 109.483 168.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 83' ' ' PHE . 36.8 p90 -112.29 170.38 8.21 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.099 0.863 . . . . 0.0 110.703 174.379 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.9 mt -135.3 135.9 41.18 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.0 2.12 . . . . 0.0 106.241 169.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.547 ' HB ' HG13 ' A' ' 81' ' ' ILE . 4.1 p -144.41 162.24 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 CA-C-N 119.398 0.999 . . . . 0.0 108.727 175.572 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.67 122.82 28.64 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 172.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.06 -30.76 71.34 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 119.085 0.857 . . . . 0.0 110.906 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.85 -10.13 29.7 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 124.359 1.064 . . . . 0.0 112.236 -176.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.16 53.73 1.96 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 176.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -47.72 -46.4 29.63 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.918 -0.489 . . . . 0.0 112.271 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -85.75 2.63 44.74 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.937 1.295 . . . . 0.0 111.969 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.5 -69.13 1.36 Allowed Glycine 0 CA--C 1.532 1.097 0 C-N-CA 126.261 1.886 . . . . 0.0 113.893 -165.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.7 m -143.47 158.72 43.42 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.451 1.5 . . . . 0.0 109.206 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.547 HG13 ' HB ' ' A' ' 72' ' ' VAL . 7.3 tt -155.51 155.11 5.97 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-N 119.315 0.961 . . . . 0.0 109.118 177.141 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.4 mt -139.02 150.59 23.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 175.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 70' ' ' TYR . 50.3 m-85 -128.86 153.77 47.14 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 126.202 1.801 . . . . 0.0 107.592 171.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -152.03 158.5 43.15 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.819 1.248 . . . . 0.0 109.793 175.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.426 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 10.3 tttt -155.62 125.53 6.53 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 123.996 0.919 . . . . 0.0 108.898 176.709 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.2 158.15 32.03 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.141 0.428 . . . . 0.0 110.646 167.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -137.87 -3.65 1.81 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 177.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 113.17 81.46 1.07 Allowed Glycine 0 C--N 1.338 0.643 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 75.44 7.55 3.96 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.189 2.596 . . . . 0.0 114.527 -173.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.1 m -141.0 160.49 39.96 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.714 1.605 . . . . 0.0 108.064 174.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 87.9 t -134.23 139.77 47.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 C-N-CA 126.324 1.85 . . . . 0.0 106.371 174.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 23.8 mm -103.15 114.82 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 173.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.8 mt -94.12 130.91 42.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 173.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -125.02 97.71 5.37 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 126.994 2.118 . . . . 0.0 107.192 -176.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 25.0 p90 -124.76 169.79 11.66 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.508 -1.37 . . . . 0.0 110.094 -171.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.4 t -154.31 168.36 26.85 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.301 0.64 . . . . 0.0 109.498 176.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.0 p -91.1 -10.59 41.44 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.779 1.632 . . . . 0.0 112.244 170.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -147.17 123.25 10.78 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.385 1.074 . . . . 0.0 110.236 -170.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 -51.99 -36.03 48.46 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 125.113 1.365 . . . . 0.0 111.695 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.03 -3.48 32.75 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.947 1.699 . . . . 0.0 114.925 -173.294 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.4 p -119.95 171.92 8.1 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -162.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.05 152.03 41.4 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 121.287 -0.883 . . . . 0.0 109.264 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -85.53 135.37 33.85 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 172.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.72 176.12 0.41 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.266 1.427 . . . . 0.0 109.391 162.244 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.28 106.0 4.48 Favored 'General case' 0 C--O 1.232 0.181 0 O-C-N 121.355 -0.84 . . . . 0.0 109.561 -175.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.451 ' HG2' HD21 ' A' ' 108' ' ' LEU . 2.5 tppt? -121.66 108.08 13.13 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 106.363 -1.718 . . . . 0.0 106.363 171.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -81.27 140.74 34.67 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 169.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.451 HD21 ' HG2' ' A' ' 106' ' ' LYS . 3.0 mm? -135.3 135.96 41.23 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 106.819 -1.548 . . . . 0.0 106.819 171.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.37 153.81 33.94 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.718 0.807 . . . . 0.0 109.648 172.142 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.0 mt -55.68 -43.12 76.06 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.268 -1.52 . . . . 0.0 108.46 166.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.9 t -51.67 -55.09 21.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.902 -0.57 . . . . 0.0 109.959 177.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -44.53 -66.34 0.4 Allowed 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 127.568 2.347 . . . . 0.0 110.48 175.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 83.4 mt -64.14 -31.65 72.93 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.665 -175.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -70.29 -39.71 74.71 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.959 -1.088 . . . . 0.0 108.225 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -51.02 61.16 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 117.885 -1.055 . . . . 0.0 108.623 174.371 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -55.68 -44.81 77.65 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 118.774 0.715 . . . . 0.0 111.705 -174.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -141.85 16.36 2.13 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -157.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -148.49 42.01 0.98 Allowed 'General case' 0 C--O 1.238 0.453 0 O-C-N 120.049 -1.657 . . . . 0.0 111.496 175.003 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.5 -26.47 13.23 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -170.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 41.5 p -92.49 -174.97 3.85 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.167 1.387 . . . . 0.0 109.765 -178.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.29 -46.64 4.96 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 120.545 -1.347 . . . . 0.0 110.768 -176.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 70.4 m -63.0 -31.01 72.05 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 119.133 0.879 . . . . 0.0 111.297 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -62.12 -16.83 55.23 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.75 -1.219 . . . . 0.0 112.9 177.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -65.35 -25.07 67.43 Favored 'General case' 0 N--CA 1.462 0.166 0 O-C-N 121.368 -0.832 . . . . 0.0 111.014 172.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -77.33 -67.67 0.69 Allowed 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 168.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -53.65 -51.76 62.12 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 124.458 1.098 . . . . 0.0 112.57 -157.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' VAL . . . . . 0.491 HG11 HD21 ' A' ' 31' ' ' LEU . 36.4 t -53.2 -55.48 12.38 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 C-N-CA 123.997 0.919 . . . . 0.0 109.216 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -67.59 -28.23 67.58 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -176.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -65.35 -38.32 89.75 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 124.553 1.141 . . . . 0.0 109.757 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 9.2 m-30 -62.47 -33.47 74.92 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.695 0.798 . . . . 0.0 111.146 169.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 11.2 t -70.24 -16.08 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 120.569 -1.332 . . . . 0.0 111.242 173.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -107.83 18.01 21.82 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.086 1.355 . . . . 0.0 110.757 173.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -122.39 18.98 8.18 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 125.658 1.599 . . . . 0.0 111.252 175.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.8 pp -125.48 151.23 46.56 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.279 1.032 . . . . 0.0 111.35 -178.025 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.579 ' CB ' HG23 ' A' ' 51' ' ' VAL . 19.1 mtt85 -72.32 178.5 3.9 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 126.98 2.112 . . . . 0.0 108.951 170.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.88 -0.89 2.05 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -175.243 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.256 1.417 0 C-N-CA 126.485 1.914 . . . . 0.0 108.138 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 . . . . . 0 N--CA 1.455 -0.218 0 CA-C-O 121.899 0.857 . . . . 0.0 112.732 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.6 p -129.69 154.59 47.0 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 104.711 -2.329 . . . . 0.0 104.711 162.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.611 ' HA ' HD12 ' A' ' 28' ' ' ILE . 2.9 m-20 -63.75 -32.64 74.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.768 0.258 . . . . 0.0 110.406 -170.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.527 ' NE2' ' H ' ' A' ' 26' ' ' GLN . 1.3 mp0 -58.63 -47.71 83.47 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.056 0.943 . . . . 0.0 111.252 175.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -62.76 -45.8 91.02 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.366 1.066 . . . . 0.0 109.289 -175.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.611 HD12 ' HA ' ' A' ' 25' ' ' ASP . 28.5 mt -61.52 -44.7 99.04 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 C-N-CA 124.817 1.247 . . . . 0.0 108.342 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.57 -37.57 56.64 Favored Glycine 0 CA--C 1.523 0.562 0 C-N-CA 124.168 0.89 . . . . 0.0 111.881 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 75.5 t -64.73 -59.77 3.71 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.137 0 CA-C-N 118.47 1.135 . . . . 0.0 109.042 173.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.43 ' CB ' HD22 ' A' ' 113' ' ' LEU . 33.9 mt -58.36 -42.48 87.03 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.432 1.014 . . . . 0.0 110.787 -172.22 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.26 93.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.64 1.176 . . . . 0.0 111.45 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.82 -25.19 75.85 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 118.164 0.438 . . . . 0.0 112.342 175.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.1 mt -69.99 -41.09 74.84 Favored 'General case' 0 C--O 1.231 0.125 0 O-C-N 120.449 -1.618 . . . . 0.0 110.008 173.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.33 -32.13 73.47 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 119.212 -0.423 . . . . 0.0 111.312 173.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.438 HG21 ' CG ' ' A' ' 95' ' ' TYR . 32.1 mm -126.75 97.74 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 125.908 1.683 . . . . 0.0 107.889 -170.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.276 1.0 OUTLIER 65.83 67.67 0.72 Allowed Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.066 1.746 . . . . 0.0 112.559 173.129 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.79 -35.73 9.16 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.261 2.641 . . . . 0.0 113.285 -176.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -58.97 -58.93 6.47 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.275 1.03 . . . . 0.0 110.104 -177.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 48.8 t90 -47.7 -49.7 27.17 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.481 1.512 . . . . 0.0 111.203 175.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.7 tt -58.86 -47.56 84.48 Favored 'General case' 0 C--N 1.34 0.155 0 O-C-N 121.624 -0.672 . . . . 0.0 110.343 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -63.24 -38.5 91.4 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 117.841 -1.076 . . . . 0.0 111.606 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -61.44 -40.1 93.23 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 119.625 1.102 . . . . 0.0 109.775 176.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -75.24 -45.51 39.73 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.16 -175.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.91 -45.3 98.52 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-N 119.487 1.039 . . . . 0.0 109.627 176.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.29 -39.26 72.41 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.807 0.73 . . . . 0.0 110.306 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.93 0.79 46.43 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 44.41 45.54 7.53 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 126.463 1.905 . . . . 0.0 111.003 -168.371 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -104.82 -2.31 24.93 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 177.445 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.0 tp -85.5 119.17 25.56 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 120.175 1.352 . . . . 0.0 110.638 -171.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 42.9 t -107.4 120.51 58.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 C-N-CA 125.544 1.538 . . . . 0.0 109.034 -178.21 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -89.94 153.3 20.72 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 128.124 2.57 . . . . 0.0 108.66 165.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -178.94 175.2 47.17 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 27.7 mm -115.12 136.3 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 124.599 1.159 . . . . 0.0 108.283 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.533 HG13 HG11 ' A' ' 61' ' ' VAL . 27.5 t -53.4 -75.82 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 129.925 3.29 . . . . 0.0 111.349 -175.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.0 mttt 59.27 167.37 0.08 OUTLIER Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 123.984 0.914 . . . . 0.0 112.191 -172.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.98 -4.47 8.93 Favored 'Trans proline' 0 CA--C 1.549 1.253 0 CA-C-N 121.104 1.43 . . . . 0.0 112.747 169.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.1 m -81.04 3.94 21.45 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 126.44 1.896 . . . . 0.0 114.989 -168.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.19 -175.42 4.1 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 120.002 1.273 . . . . 0.0 111.335 171.168 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.458 ' O ' HG13 ' A' ' 61' ' ' VAL . 8.9 t -75.51 143.8 42.32 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 162.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.533 HG11 HG13 ' A' ' 55' ' ' VAL . 0.4 OUTLIER -160.64 157.62 23.87 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 124.316 1.046 . . . . 0.0 110.296 165.583 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.36 -177.99 3.67 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 123.891 3.061 . . . . 0.0 111.379 174.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.71 137.2 40.47 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 123.639 0.776 . . . . 0.0 112.567 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.15 60.75 6.78 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 125.131 1.348 . . . . 0.0 109.874 173.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -144.16 30.59 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 125.536 1.535 . . . . 0.0 109.785 165.132 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -55.19 -15.76 2.6 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 117.7 2.481 . . . . 0.0 117.7 -160.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -154.6 26.74 0.45 Allowed 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.362 1.465 . . . . 0.0 110.488 171.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -71.96 108.85 5.42 Favored 'General case' 0 CA--C 1.519 -0.234 0 O-C-N 121.321 -0.862 . . . . 0.0 108.742 174.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.4 m -50.24 137.69 17.7 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.235 1.414 . . . . 0.0 109.846 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 23.8 p90 -118.97 160.8 21.32 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 118.71 0.686 . . . . 0.0 111.33 -177.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.0 mt -135.82 133.78 38.2 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 127.566 2.346 . . . . 0.0 106.43 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.9 p -161.72 167.87 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 105.161 -2.163 . . . . 0.0 105.161 -169.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.06 -175.93 4.83 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.999 -1.063 . . . . 0.0 108.67 169.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -93.18 -14.46 27.12 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.6 -0.688 . . . . 0.0 112.759 161.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -139.28 22.21 2.57 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.932 0.893 . . . . 0.0 112.166 -161.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -138.17 34.45 2.33 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.8 1.64 . . . . 0.0 107.926 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -60.99 -18.79 59.52 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 119.651 -1.905 . . . . 0.0 113.473 -160.314 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -98.73 3.47 47.63 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.786 1.634 . . . . 0.0 113.779 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -94.96 -128.84 5.53 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 125.931 1.729 . . . . 0.0 111.679 -171.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 25.4 m -70.75 156.28 39.71 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.595 -0.944 . . . . 0.0 109.069 173.077 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.3 tt -151.03 158.92 4.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 164.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 57.9 mt -136.07 143.12 36.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 106.055 -1.831 . . . . 0.0 106.055 174.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -122.21 154.98 36.78 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 172.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -156.69 158.82 37.65 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.24 -0.912 . . . . 0.0 108.918 169.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.4 tttt -142.19 109.35 5.54 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 160.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.589 ' HB3' HD13 ' A' ' 28' ' ' ILE . . . -82.69 149.93 27.05 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 165.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -141.64 -154.12 0.5 Allowed 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 128.352 2.661 . . . . 0.0 107.144 -171.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -68.97 89.29 0.24 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 125.073 1.32 . . . . 0.0 110.026 -176.269 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 62.22 11.0 4.13 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.989 2.116 . . . . 0.0 114.149 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.89 162.9 24.83 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.515 1.507 . . . . 0.0 108.934 174.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 107' ' ' ALA . 8.4 p -146.82 151.86 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.145 0 C-N-CA 124.811 1.245 . . . . 0.0 108.06 168.669 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.422 HG22 ' HG3' ' A' ' 94' ' ' LYS . 3.4 mp -116.53 109.45 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 166.135 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.2 mt -83.04 127.54 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 165.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.422 ' HG3' HG22 ' A' ' 92' ' ' ILE . 75.7 mttt -120.15 105.29 10.84 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.417 1.887 . . . . 0.0 109.017 178.627 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.438 ' CG ' HG21 ' A' ' 36' ' ' ILE . 26.7 p90 -126.02 167.68 14.99 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.858 -1.151 . . . . 0.0 110.461 -176.448 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -156.79 163.59 39.06 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.574 1.55 . . . . 0.0 107.303 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 45.5 p -82.21 -17.32 46.54 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 169.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -145.43 133.17 21.08 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.94 -41.58 11.76 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 129.38 3.072 . . . . 0.0 111.312 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -81.66 7.16 13.07 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -175.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.8 p -136.71 132.61 35.11 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.018 -1.677 . . . . 0.0 111.914 -169.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.414 ' HD2' ' H ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -53.65 147.27 11.67 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.432 1.093 . . . . 0.0 112.712 -166.034 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.444 ' H ' HD22 ' A' ' 103' ' ' LEU . 1.8 mm? -71.1 163.61 27.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.568 1.547 . . . . 0.0 111.79 -172.574 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.3 mptp? -84.17 177.39 8.24 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 127.454 2.302 . . . . 0.0 109.332 167.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -123.95 118.81 27.88 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.221 1.808 . . . . 0.0 107.955 171.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -127.62 126.47 42.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 103.967 -2.605 . . . . 0.0 103.967 164.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.41 ' HA ' ' O ' ' A' ' 91' ' ' VAL . . . -123.86 130.29 52.36 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 120.924 1.693 . . . . 0.0 108.914 179.565 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 29.2 mt -134.48 155.88 49.59 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 -173.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.5 p -87.18 151.0 23.56 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 121.282 1.856 . . . . 0.0 109.107 170.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 16.6 mt -58.66 -40.4 83.38 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-O 121.762 0.791 . . . . 0.0 109.755 -176.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.3 -37.33 82.82 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 124.407 1.083 . . . . 0.0 110.914 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -57.77 11.09 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 125.931 1.692 . . . . 0.0 112.255 173.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' LEU . . . . . 0.575 HD23 ' OE2' ' A' ' 116' ' ' GLU . 14.7 mt -56.35 -33.01 65.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.702 1.137 . . . . 0.0 110.136 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -72.59 12.1 0.53 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.127 1.371 . . . . 0.0 113.713 175.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.26 -35.02 1.04 Allowed 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.945 1.698 . . . . 0.0 110.86 -176.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLU . . . . . 0.575 ' OE2' HD23 ' A' ' 113' ' ' LEU . 2.4 pt-20 -61.91 -86.41 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 154.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.493 ' CD2' ' HB2' ' A' ' 116' ' ' GLU . 98.7 m-85 -90.82 18.57 6.37 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.724 0.773 . . . . 0.0 110.233 -162.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -147.23 100.18 3.24 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 174.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -132.33 -33.56 1.28 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.8 t -130.95 143.31 50.63 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 120.827 1.649 . . . . 0.0 110.441 -168.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -62.14 -36.59 82.26 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 119.756 -1.84 . . . . 0.0 112.334 -171.382 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 26.9 t -62.52 -20.1 64.28 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 117.23 -1.367 . . . . 0.0 112.934 176.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -66.32 -23.37 66.35 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 121.046 1.748 . . . . 0.0 111.508 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.7 mttt -60.61 -6.35 1.63 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 126.335 1.854 . . . . 0.0 113.342 -175.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -104.56 -8.82 18.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 122.903 1.335 . . . . 0.0 114.122 -176.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.95 -62.66 1.56 Allowed 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 127.272 2.229 . . . . 0.0 108.916 176.484 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.8 t -57.69 -42.77 82.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 124.409 1.084 . . . . 0.0 111.467 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -76.27 -13.79 60.15 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 171.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -79.47 -41.72 26.87 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 125.051 1.34 . . . . 0.0 112.849 -179.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -59.02 -29.23 67.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.912 0.485 . . . . 0.0 110.29 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.3 t -67.03 -26.82 37.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 123.926 0.89 . . . . 0.0 111.437 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -96.96 -16.46 20.62 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.82 0.736 . . . . 0.0 111.849 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.43 -7.38 76.13 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.705 0.684 . . . . 0.0 112.878 -179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -84.81 176.19 8.67 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.902 1.281 . . . . 0.0 109.757 167.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -139.06 165.85 26.05 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 127.101 2.16 . . . . 0.0 108.368 -175.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.11 21.52 6.26 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.838 0.855 . . . . 0.0 110.459 178.39 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 . . . . . 0 C--O 1.251 1.153 0 C-N-CA 129.839 3.256 . . . . 0.0 110.249 -160.288 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 . . . . . 0 CA--C 1.542 0.673 0 CA-C-O 121.287 0.565 . . . . 0.0 109.498 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.6 146.6 48.11 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 128.075 2.55 . . . . 0.0 106.143 171.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -55.86 -39.89 72.13 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.867 0.467 . . . . 0.0 110.45 -171.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -45.48 94.56 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.175 0.898 . . . . 0.0 110.511 -176.159 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.5 mm-40 -61.01 -34.93 75.59 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 124.835 1.254 . . . . 0.0 110.817 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 96.6 mt -74.05 -41.14 52.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 C-N-CA 124.517 1.127 . . . . 0.0 109.748 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.58 -42.49 90.49 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 124.967 1.27 . . . . 0.0 111.797 -175.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.3 t -60.82 -45.45 97.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-N 117.107 0.454 . . . . 0.0 110.742 176.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 46.1 mt -63.61 -45.37 90.61 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.933 0.788 . . . . 0.0 109.593 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.54 -47.45 73.16 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.386 1.075 . . . . 0.0 110.251 176.303 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.41 -22.67 78.81 Favored Glycine 0 CA--C 1.523 0.579 0 O-C-N 121.696 -0.627 . . . . 0.0 112.504 178.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 38' ' ' PRO . 2.1 tp -69.61 -17.79 63.56 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.052 1.926 . . . . 0.0 112.207 174.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.438 ' HB2' ' HE2' ' A' ' 117' ' ' PHE . . . -91.26 -20.88 21.43 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 117.012 -1.47 . . . . 0.0 113.083 170.111 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.5 mp -134.28 105.58 6.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 -176.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.287 2.3 p 57.31 62.06 5.9 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.665 1.986 . . . . 0.0 112.141 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.421 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 39.0 Cg_endo -67.41 -42.14 7.82 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.914 3.076 . . . . 0.0 111.016 176.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.57 -51.38 63.05 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -172.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -45.62 -48.13 14.7 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.873 0.869 . . . . 0.0 111.194 168.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.7 -52.59 63.69 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 -175.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -64.38 -32.99 74.82 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.132 0.973 . . . . 0.0 112.321 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -62.42 -52.06 65.05 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 119.887 1.221 . . . . 0.0 108.29 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -66.55 -37.44 84.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 117.972 -1.013 . . . . 0.0 111.875 -176.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 31.5 mm -59.19 -51.04 77.26 Favored 'Isoleucine or valine' 0 C--N 1.342 0.26 0 CA-C-N 119.777 1.171 . . . . 0.0 109.441 172.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.38 -38.14 79.74 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.992 0.815 . . . . 0.0 111.068 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.07 -8.3 55.12 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.299 1.04 . . . . 0.0 113.134 176.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 48.05 37.47 7.89 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.62 1.568 . . . . 0.0 112.016 -166.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.5 -6.66 21.56 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.456 1.502 . . . . 0.0 112.288 -177.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.26 128.85 35.88 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -173.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.6 t -114.31 156.49 15.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 174.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -123.31 145.25 48.87 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 127.423 2.289 . . . . 0.0 106.777 176.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -158.01 175.11 35.3 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 121.76 0.644 . . . . 0.0 113.451 -178.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mm -123.02 135.92 61.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.599 0 CA-C-O 124.808 2.242 . . . . 0.0 107.423 177.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.599 HG12 HG11 ' A' ' 61' ' ' VAL . 0.8 OUTLIER -68.03 -59.18 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.809 0 C-N-CA 131.282 3.833 . . . . 0.0 109.817 -177.346 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 56.52 165.23 0.07 OUTLIER Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 127.681 2.392 . . . . 0.0 113.34 -170.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.25 80.54 1.01 Allowed 'Trans proline' 0 N--CA 1.448 -1.182 0 N-CA-C 107.528 -1.758 . . . . 0.0 107.528 155.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.5 t -159.1 -72.72 0.08 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.309 -1.738 . . . . 0.0 106.309 162.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.89 160.84 7.18 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 123.525 0.73 . . . . 0.0 112.611 -164.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 m -66.42 112.03 3.85 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 172.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.599 HG11 HG12 ' A' ' 55' ' ' VAL . 8.5 m -140.0 160.58 59.89 Favored Pre-proline 0 C--O 1.238 0.488 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 178.054 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.28 168.02 18.84 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.37 2.047 . . . . 0.0 110.794 171.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.11 132.86 49.48 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 171.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 99.7 37.32 3.99 Favored Glycine 0 CA--C 1.492 -1.395 0 CA-C-O 118.399 -1.223 . . . . 0.0 114.198 170.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.873 HG23 ' HB2' ' A' ' 68' ' ' TYR 0.296 1.6 p -174.1 56.17 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 CA-C-O 123.018 1.39 . . . . 0.0 107.701 -168.175 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -86.76 -4.52 59.19 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.732 1.613 . . . . 0.0 112.011 177.081 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -164.51 20.48 0.06 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.031 2.132 . . . . 0.0 110.719 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.873 ' HB2' HG23 ' A' ' 65' ' ' VAL . 4.5 m-85 -83.69 100.18 10.71 Favored 'General case' 0 CA--C 1.52 -0.185 0 C-N-CA 126.128 1.771 . . . . 0.0 109.241 174.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -44.2 139.96 2.36 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 127.096 2.158 . . . . 0.0 111.86 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.408 ' HD2' HG13 ' A' ' 55' ' ' VAL . 47.0 p90 -127.12 166.93 16.72 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.485 1.114 . . . . 0.0 112.731 -175.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 19.1 mt -139.16 124.9 19.59 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 127.387 2.275 . . . . 0.0 106.347 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -150.59 143.47 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 126.138 1.775 . . . . 0.0 106.463 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.1 156.15 34.11 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 169.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.95 -24.32 62.44 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -174.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -111.46 3.73 18.33 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.434 1.894 . . . . 0.0 110.952 -174.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -101.27 19.82 16.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.203 1.801 . . . . 0.0 111.23 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -44.97 -43.34 8.99 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 126.532 1.933 . . . . 0.0 113.693 -169.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -124.99 13.78 8.46 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.662 1.185 . . . . 0.0 111.479 170.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.67 -68.65 1.52 Allowed Glycine 0 CA--C 1.522 0.518 0 C-N-CA 126.215 1.864 . . . . 0.0 110.209 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.4 m -148.91 156.98 43.08 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.861 0.864 . . . . 0.0 108.805 179.163 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.5 tt -155.88 159.79 2.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 172.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.595 HG23 ' HB3' ' A' ' 95' ' ' TYR . 9.7 mt -134.93 157.04 40.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 166.625 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.462 ' CD2' HG21 ' A' ' 65' ' ' VAL . 81.1 m-85 -133.13 155.97 48.29 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.122 2.569 . . . . 0.0 107.624 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -164.79 160.45 19.62 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.472 -1.393 . . . . 0.0 109.29 175.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.473 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -149.11 127.45 12.19 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 169.78 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.56 117.67 19.96 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 164.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -100.28 22.28 11.77 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.58 1.552 . . . . 0.0 109.703 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 86.58 121.09 1.3 Allowed Glycine 0 C--N 1.34 0.78 0 C-N-CA 125.324 1.44 . . . . 0.0 110.417 -177.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 50.82 1.01 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.656 2.382 . . . . 0.0 116.385 -171.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -151.5 145.27 25.06 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 126.028 1.731 . . . . 0.0 107.112 -162.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 68.0 t -138.4 108.63 4.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 125.119 1.368 . . . . 0.0 108.075 -175.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.415 HD12 ' H ' ' A' ' 92' ' ' ILE . 4.5 mp -77.88 104.62 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 162.243 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 34.2 mt -76.98 135.15 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 106.212 -1.773 . . . . 0.0 106.212 165.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -126.74 103.07 7.34 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.628 1.571 . . . . 0.0 109.825 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.595 ' HB3' HG23 ' A' ' 82' ' ' ILE . 40.6 p90 -119.72 165.56 14.36 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.067 -1.646 . . . . 0.0 111.322 -174.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.6 t -156.9 169.97 23.56 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.588 1.555 . . . . 0.0 108.019 171.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 m -109.86 -9.05 14.81 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.19 1.396 . . . . 0.0 111.114 172.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -136.0 112.82 10.22 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.5 1.52 . . . . 0.0 108.586 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -48.44 -32.89 8.38 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 126.188 1.795 . . . . 0.0 112.583 175.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . 0.296 0.0 OUTLIER -79.29 3.77 17.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.132 1.901 . . . . 0.0 116.132 178.051 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.2 p -120.3 165.75 14.44 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 119.078 0.854 . . . . 0.0 111.168 -178.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -66.26 158.01 30.07 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.341 0.591 . . . . 0.0 110.247 -174.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 61.2 mt -91.38 142.7 27.4 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.475 0.71 . . . . 0.0 109.457 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.08 173.08 0.87 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.348 0.659 . . . . 0.0 109.533 164.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.62 112.66 9.09 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.549 1.14 . . . . 0.0 108.199 170.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.2 tptt -123.03 97.69 5.55 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 105.314 -2.106 . . . . 0.0 105.314 178.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.94 126.57 35.45 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 178.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -123.3 157.94 32.09 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.895 1.278 . . . . 0.0 108.179 174.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.3 158.87 33.24 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.346 -0.846 . . . . 0.0 110.145 162.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 17.2 mt -47.13 -54.49 10.41 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.168 0.987 . . . . 0.0 109.665 162.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.27 -30.84 70.71 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 117.138 -1.41 . . . . 0.0 112.116 -174.013 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -62.79 -57.83 9.55 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 120.073 1.306 . . . . 0.0 109.867 173.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 92.8 mt -55.64 -32.14 62.92 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.463 0.574 . . . . 0.0 111.376 -178.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.8 tttm -70.64 -47.03 62.11 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 118.677 -0.678 . . . . 0.0 111.635 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -50.83 71.83 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 119.155 0.889 . . . . 0.0 108.773 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -57.36 -62.38 1.81 Allowed 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 124.882 1.273 . . . . 0.0 109.025 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' PHE . . . . . 0.438 ' HE2' ' HB2' ' A' ' 35' ' ' ALA . 19.2 m-85 -127.99 13.38 6.77 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -157.429 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -143.77 58.03 1.36 Allowed 'General case' 0 C--O 1.24 0.586 0 O-C-N 119.792 -1.818 . . . . 0.0 109.901 173.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.47 -34.69 6.69 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.825 -168.39 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.2 t -107.55 148.05 29.75 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 125.297 1.439 . . . . 0.0 110.294 -173.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -60.82 -28.97 69.2 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.684 -1.26 . . . . 0.0 110.756 175.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.97 -39.22 74.18 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 119.589 1.086 . . . . 0.0 111.243 176.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -18.52 60.64 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -78.32 -2.46 38.2 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.659 178.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.87 -79.71 0.2 Allowed 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 153.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -52.11 -61.88 1.99 Allowed 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -160.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 76.0 t -55.8 -36.94 45.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 118.534 0.606 . . . . 0.0 110.559 -176.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -77.34 -30.22 53.85 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.999 1.32 . . . . 0.0 111.896 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.41 -49.76 74.2 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 126.009 1.724 . . . . 0.0 109.394 164.536 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -59.25 -38.77 80.88 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.769 0.713 . . . . 0.0 110.543 -176.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 90.1 t -64.3 -33.26 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 118.983 0.811 . . . . 0.0 111.08 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -86.38 -23.35 26.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 118.86 0.755 . . . . 0.0 112.53 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.88 -32.19 13.4 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 125.003 1.287 . . . . 0.0 111.825 -176.505 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.3 pp -56.5 125.5 22.35 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 166.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -79.73 167.37 20.72 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 9.9 m -134.43 6.64 3.55 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 120.353 -1.467 . . . . 0.0 111.398 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.921 0 C-N-CA 127.719 2.408 . . . . 0.0 104.774 163.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.442 ' CZ ' ' HE3' ' A' ' 114' ' ' LYS . 4.5 m-85 . . . . . 0 CA--C 1.548 0.896 0 CA-C-O 121.109 0.481 . . . . 0.0 110.983 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.3 p -138.53 150.26 46.19 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.787 2.035 . . . . 0.0 107.326 171.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -59.4 -41.72 90.1 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.423 0.556 . . . . 0.0 110.106 -174.017 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -44.44 -56.04 4.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.385 1.874 . . . . 0.0 111.433 169.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -69.43 -30.86 68.89 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.904 1.282 . . . . 0.0 112.605 -174.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.491 HG21 ' HB2' ' A' ' 86' ' ' ALA . 48.2 mt -80.2 -34.96 15.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 C-N-CA 123.22 0.608 . . . . 0.0 109.821 -179.024 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.403 ' CA ' ' CZ ' ' A' ' 84' ' ' PHE . . . -55.73 -44.97 86.69 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 124.048 0.832 . . . . 0.0 112.055 -173.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.6 t -56.02 -50.49 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 118.306 1.053 . . . . 0.0 109.321 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 53.4 mt -58.26 -39.31 78.87 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.334 0.97 . . . . 0.0 110.832 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.13 -47.35 80.27 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 118.879 -0.581 . . . . 0.0 111.816 176.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.71 -29.27 72.73 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.976 0.807 . . . . 0.0 111.378 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.8 mt -62.08 -28.31 69.52 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 120.356 -1.673 . . . . 0.0 110.62 172.046 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.26 -12.99 59.95 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 117.111 -1.423 . . . . 0.0 113.094 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.0 mm -143.64 98.95 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 125.799 1.64 . . . . 0.0 107.309 -173.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t 56.71 68.65 2.06 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 124.836 1.254 . . . . 0.0 112.083 -175.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.32 -37.87 69.44 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.328 2.018 . . . . 0.0 110.711 176.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -47.01 77.74 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 118.185 -0.912 . . . . 0.0 112.078 -173.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 59.4 t90 -52.93 -52.94 56.13 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tt -58.15 -52.0 67.38 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 121.454 -0.779 . . . . 0.0 110.929 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -57.83 -35.17 70.51 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 118.574 -0.727 . . . . 0.0 111.123 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -69.66 -50.7 41.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 178.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -59.19 -38.41 79.76 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.354 -0.831 . . . . 0.0 112.305 -177.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 31.4 mm -60.53 -53.19 52.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 119.319 0.963 . . . . 0.0 109.36 173.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.65 -41.2 81.0 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 117.836 0.289 . . . . 0.0 110.749 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.53 -17.66 63.6 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.505 1.522 . . . . 0.0 113.141 176.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.1 t30 59.02 30.05 19.77 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.641 1.577 . . . . 0.0 110.838 -169.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -94.22 -16.65 23.46 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.879 1.272 . . . . 0.0 112.703 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.57 135.7 35.57 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.439 1.496 . . . . 0.0 109.59 -169.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 45.8 t -122.15 145.69 28.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 124.759 1.224 . . . . 0.0 108.004 170.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -106.31 136.22 46.42 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 128.049 2.54 . . . . 0.0 106.683 173.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -153.36 178.65 30.27 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-O 122.9 1.278 . . . . 0.0 113.697 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 26.8 mm -130.49 137.82 55.27 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.932 0 C-N-CA 127.981 2.512 . . . . 0.0 108.14 -171.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.605 HG12 HG11 ' A' ' 61' ' ' VAL 0.255 2.8 m -70.59 -75.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.409 -2.503 0 CA-C-N 108.823 -3.808 . . . . 0.0 108.675 179.398 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp 55.39 167.39 0.05 OUTLIER Pre-proline 0 C--N 1.349 0.543 0 C-N-CA 125.301 1.44 . . . . 0.0 111.573 -173.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -66.84 73.18 0.44 Allowed 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 121.719 1.613 . . . . 0.0 110.375 164.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.3 t -153.16 -63.67 0.15 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.826 1.25 . . . . 0.0 112.65 175.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.68 175.73 9.08 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 120.566 1.53 . . . . 0.0 110.935 -172.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 t -93.69 121.15 34.83 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 -179.513 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.605 HG11 HG12 ' A' ' 55' ' ' VAL . 4.8 m -150.42 160.8 32.28 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 123.957 0.903 . . . . 0.0 109.011 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -71.5 158.92 52.79 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.937 1.758 . . . . 0.0 111.092 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.19 129.55 40.62 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 173.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.64 22.99 9.72 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 117.461 -1.744 . . . . 0.0 114.824 174.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.2 m -141.2 70.01 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.8 1.8 . . . . 0.0 110.1 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -85.3 -11.49 54.58 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.923 1.689 . . . . 0.0 114.61 -172.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -170.44 25.68 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 126.266 1.826 . . . . 0.0 109.506 -166.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.431 ' CD1' ' HB2' ' A' ' 85' ' ' LYS . 3.5 m-85 -94.98 105.75 17.69 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.687 1.595 . . . . 0.0 107.426 176.832 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.08 150.11 4.66 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 118.99 0.813 . . . . 0.0 110.69 172.492 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -130.73 158.46 40.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.174 0.59 . . . . 0.0 111.03 -176.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -120.63 128.48 53.05 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 127.096 2.158 . . . . 0.0 106.98 174.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -153.22 159.62 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 173.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.419 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -89.78 161.45 16.02 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.371 0.605 . . . . 0.0 110.407 176.479 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.8 -5.59 4.5 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.106 0.962 . . . . 0.0 113.52 172.046 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -140.3 22.63 2.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.659 0.784 . . . . 0.0 110.972 -175.065 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.419 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 19.7 m-20 -127.0 29.18 5.66 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.407 1.883 . . . . 0.0 109.407 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -63.61 -5.33 3.81 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 119.252 -2.155 . . . . 0.0 114.33 -177.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -143.19 22.49 1.88 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.093 1.357 . . . . 0.0 111.511 160.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.12 -71.83 1.31 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 125.634 1.587 . . . . 0.0 111.198 -176.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 21.4 m -145.29 160.78 40.99 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.206 1.802 . . . . 0.0 107.572 177.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tt -152.4 155.04 7.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 168.058 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 16.2 mt -130.76 140.52 48.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 166.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -114.83 146.82 40.64 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.326 1.85 . . . . 0.0 109.2 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PHE . . . . . 0.403 ' CZ ' ' CA ' ' A' ' 29' ' ' GLY . 45.1 p90 -151.59 156.74 41.07 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.126 -0.984 . . . . 0.0 110.92 172.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.431 ' HB2' ' CD1' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -148.57 90.29 1.77 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.859 2.064 . . . . 0.0 110.248 178.836 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.491 ' HB2' HG21 ' A' ' 28' ' ' ILE . . . -72.36 104.42 3.74 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 119.287 -0.965 . . . . 0.0 109.006 172.301 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.14 128.83 55.34 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 125.666 1.586 . . . . 0.0 108.265 174.054 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 57.19 -89.23 0.01 OUTLIER Glycine 0 CA--C 1.528 0.875 0 C-N-CA 125.035 1.302 . . . . 0.0 111.735 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.486 ' HA ' HD12 ' A' ' 110' ' ' LEU . 17.6 mp0 -137.85 17.21 2.86 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.421 2.688 . . . . 0.0 112.024 -174.111 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 88.6 m -137.29 142.3 41.93 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.981 1.712 . . . . 0.0 110.154 -172.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.8 t -128.36 100.72 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 126.566 1.947 . . . . 0.0 107.04 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.633 HD12 ' H ' ' A' ' 92' ' ' ILE . 3.3 mp -72.44 77.62 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 130.091 3.357 . . . . 0.0 109.198 165.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mt -65.14 129.85 29.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 173.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -128.47 121.3 28.61 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.533 1.133 . . . . 0.0 108.073 -176.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -145.21 169.54 18.01 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 121.122 -0.986 . . . . 0.0 110.72 -168.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.5 t -157.01 174.45 15.5 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.623 0.725 . . . . 0.0 111.29 -171.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.2 p -106.58 -8.99 16.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.615 1.166 . . . . 0.0 112.056 165.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -144.42 147.57 33.53 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.68 0.792 . . . . 0.0 111.827 -175.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.9 ttt-85 -81.57 10.94 5.13 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.582 1.153 . . . . 0.0 112.088 173.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -116.86 3.74 12.91 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.418 1.487 . . . . 0.0 114.039 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 34.4 p -130.27 176.1 8.39 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.75 0.82 . . . . 0.0 112.702 -166.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.73 148.56 44.55 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.027 1.331 . . . . 0.0 109.061 172.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 84.9 mt -86.42 142.12 28.65 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 126.434 1.894 . . . . 0.0 108.872 175.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -64.37 168.81 5.28 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.276 1.03 . . . . 0.0 109.841 167.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -129.43 103.72 7.07 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.274 1.43 . . . . 0.0 109.55 -179.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.1 tptt -122.29 92.16 3.66 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -82.01 120.25 25.02 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 171.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.12 145.49 45.91 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 126.737 2.015 . . . . 0.0 106.674 168.061 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 2.4 p -67.37 157.59 33.69 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 121.536 -0.727 . . . . 0.0 111.207 173.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 89' ' ' GLN . 13.1 mt -51.87 -46.04 64.33 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 121.823 -0.548 . . . . 0.0 110.493 166.041 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.26 -41.01 98.99 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 117.194 -1.384 . . . . 0.0 111.081 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -62.39 1.64 Allowed 'General case' 0 C--N 1.345 0.41 0 CA-C-N 119.402 1.001 . . . . 0.0 109.382 174.244 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 56.7 mt -60.97 -38.27 85.35 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -174.262 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.442 ' HE3' ' CZ ' ' A' ' 23' ' ' PHE . 1.9 ttmp? -62.99 -43.1 99.72 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 118.849 -0.596 . . . . 0.0 109.77 176.474 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -56.38 13.94 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.491 1.041 . . . . 0.0 108.354 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -51.69 -42.12 61.94 Favored 'General case' 0 C--O 1.23 0.075 0 C-N-CA 124.929 1.292 . . . . 0.0 111.899 -174.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -132.01 20.39 4.52 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.8 0.44 . . . . 0.0 112.135 -165.351 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -161.99 61.43 0.24 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 122.125 0.964 . . . . 0.0 111.082 176.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.27 -47.85 4.19 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.016 0.926 . . . . 0.0 111.697 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 80.8 p -88.5 161.49 16.96 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 121.246 -0.909 . . . . 0.0 110.137 179.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -83.06 -32.2 26.94 Favored 'General case' 0 C--N 1.334 -0.104 0 O-C-N 121.807 -0.558 . . . . 0.0 110.599 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.88 -37.09 80.98 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.981 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -65.92 -29.16 69.53 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.972 1.26 . . . . 0.0 111.793 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -56.38 -34.34 66.58 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 118.741 -0.647 . . . . 0.0 112.328 -172.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.56 -71.14 0.08 Allowed 'General case' 0 C--O 1.215 -0.739 0 C-N-CA 125.566 1.546 . . . . 0.0 108.155 174.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -47.9 -57.81 5.21 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 124.165 0.986 . . . . 0.0 112.585 178.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 92.3 t -55.95 -41.92 69.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.636 -174.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -77.76 -28.68 50.71 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.787 0.721 . . . . 0.0 112.091 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -58.91 -44.65 91.32 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 169.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -58.75 -28.48 65.92 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.225 0.61 . . . . 0.0 111.05 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.71 -14.22 18.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 123.609 0.764 . . . . 0.0 111.628 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -123.0 -12.36 7.98 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 120.174 1.352 . . . . 0.0 112.858 178.469 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -79.89 -21.08 66.59 Favored Glycine 0 CA--C 1.525 0.665 0 O-C-N 121.466 -0.771 . . . . 0.0 111.269 168.236 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.4 pp -68.52 141.04 55.65 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.369 1.085 . . . . 0.0 108.118 162.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -88.69 170.26 10.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 169.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 8.5 m -130.92 9.26 4.89 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.821 -1.175 . . . . 0.0 110.215 172.143 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 C--O 1.236 0.375 0 C-N-CA 128.24 2.616 . . . . 0.0 104.48 172.791 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 . . . . . 0 C--O 1.234 0.254 0 CA-C-O 122.375 1.083 . . . . 0.0 109.255 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -137.17 155.97 48.91 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 126.929 2.092 . . . . 0.0 107.243 -170.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -49.68 -49.22 48.39 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.444 1.098 . . . . 0.0 110.722 175.218 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -44.82 -56.9 4.1 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.319 1.448 . . . . 0.0 112.332 172.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -70.92 -39.24 72.82 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.276 1.03 . . . . 0.0 110.602 -171.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 79.2 mt -64.86 -31.72 55.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.247 1.019 . . . . 0.0 109.237 175.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -49.44 -55.22 13.68 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 125.759 1.647 . . . . 0.0 111.843 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.0 t -68.31 -39.39 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 119.026 -0.512 . . . . 0.0 109.64 -173.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.9 mp -62.0 -52.74 62.78 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.908 0.776 . . . . 0.0 111.034 177.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.19 -31.43 72.57 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.574 0.625 . . . . 0.0 111.049 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.5 -27.24 70.56 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 118.637 0.653 . . . . 0.0 112.988 172.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.25 -27.45 60.77 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.977 1.889 . . . . 0.0 112.098 177.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.8 -25.92 64.93 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.891 170.305 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.1 mm -130.86 87.44 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 124.601 1.16 . . . . 0.0 108.68 -166.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.96 60.29 0.62 Allowed Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.009 1.324 . . . . 0.0 111.552 172.922 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -57.94 -37.52 95.79 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 123.236 2.624 . . . . 0.0 111.601 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -60.07 -41.66 92.89 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.376 0.67 . . . . 0.0 111.434 -178.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 37.1 t90 -61.16 -57.64 11.64 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 tt -50.25 -48.26 54.81 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.529 0.732 . . . . 0.0 110.337 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -63.95 -45.4 89.35 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.836 0.854 . . . . 0.0 111.376 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -59.89 -40.41 88.63 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.93 0.786 . . . . 0.0 111.208 173.346 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -63.68 -54.34 37.05 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -178.476 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 30.0 mm -55.49 -41.72 64.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.407 1.083 . . . . 0.0 109.691 178.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.84 7.21 1.64 Allowed 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.35 21.71 2.96 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.364 -0.835 . . . . 0.0 110.731 159.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.2 t30 50.95 25.0 2.02 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.373 2.269 . . . . 0.0 112.96 -175.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -81.24 -15.23 56.22 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 119.909 -1.744 . . . . 0.0 112.721 -174.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 tp -69.45 133.64 47.98 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 119.459 1.027 . . . . 0.0 109.044 -175.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.8 t -112.91 154.79 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 106.257 -1.757 . . . . 0.0 106.257 169.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -123.0 145.97 48.04 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 128.394 2.678 . . . . 0.0 107.209 173.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -162.86 171.13 38.58 Favored Glycine 0 C--N 1.332 0.348 0 O-C-N 121.166 -0.959 . . . . 0.0 113.687 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 31.4 mm -114.98 133.38 61.33 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.595 0 C-N-CA 126.804 2.042 . . . . 0.0 106.417 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.534 ' HA ' HG11 ' A' ' 61' ' ' VAL . 0.5 OUTLIER -44.5 -54.21 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.589 1 C-N-CA 133.237 4.615 . . . . 0.0 112.266 169.271 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 19.8 mttt 62.89 159.65 0.12 Allowed Pre-proline 0 CA--C 1.536 0.421 0 C-N-CA 126.666 1.987 . . . . 0.0 112.971 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -70.75 -12.28 30.79 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.324 2.682 . . . . 0.0 113.278 -178.027 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 47.8 m -149.55 90.69 1.74 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.366 1.466 . . . . 0.0 107.795 170.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -138.92 -165.16 1.78 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 156.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.7 t -92.71 36.76 1.01 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.336 1.454 . . . . 0.0 112.585 -170.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.534 HG11 ' HA ' ' A' ' 55' ' ' VAL . 9.5 m -105.73 153.24 40.1 Favored Pre-proline 0 C--N 1.324 -0.539 0 C-N-CA 123.43 0.692 . . . . 0.0 109.252 -167.229 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.99 178.04 4.47 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.998 2.465 . . . . 0.0 111.311 -174.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.92 160.04 24.8 Favored 'General case' 0 C--O 1.238 0.482 0 O-C-N 121.185 -0.947 . . . . 0.0 109.35 170.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.9 33.74 65.81 Favored Glycine 0 CA--C 1.529 0.967 0 CA-C-O 119.615 -0.547 . . . . 0.0 112.117 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.2 m -146.34 25.38 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 125.923 1.689 . . . . 0.0 110.398 176.323 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.47 -5.14 0.3 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 127.778 2.431 . . . . 0.0 116.674 -164.669 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -157.57 15.98 0.25 Allowed 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 127.187 2.195 . . . . 0.0 109.883 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.491 ' CE2' ' HE3' ' A' ' 94' ' ' LYS . 5.6 m-85 -86.98 100.83 12.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.23 148.6 8.24 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.685 0.675 . . . . 0.0 110.076 174.566 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 46.6 p90 -123.38 166.78 14.76 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.422 1.089 . . . . 0.0 111.244 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 31.2 mt -136.27 130.46 33.03 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 127.564 2.346 . . . . 0.0 105.282 176.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.1 p -148.96 151.77 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 176.288 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -86.49 143.89 27.52 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.56 1.073 . . . . 0.0 109.003 176.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.19 -10.26 4.3 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 128.246 2.618 . . . . 0.0 114.604 -171.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.83 7.05 4.37 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.804 1.241 . . . . 0.0 111.609 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -134.58 31.82 3.37 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.188 1.795 . . . . 0.0 107.215 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -67.87 -18.69 64.89 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.449 1.5 . . . . 0.0 113.116 -166.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.75 20.66 12.24 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.59 1.956 . . . . 0.0 109.471 174.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.2 -98.36 2.56 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 126.535 2.017 . . . . 0.0 109.478 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.4 m -74.58 162.28 28.92 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.603 1.161 . . . . 0.0 108.57 169.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.9 tt -161.42 154.83 3.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 O-C-N 121.005 -1.059 . . . . 0.0 108.741 153.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.54 HG23 ' HB3' ' A' ' 95' ' ' TYR . 3.6 mt -138.34 147.77 25.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 175.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -133.39 156.66 47.26 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 127.894 2.477 . . . . 0.0 108.567 -174.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -162.7 159.61 24.54 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.408 -1.432 . . . . 0.0 111.174 174.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.52 115.88 6.2 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.94 1.296 . . . . 0.0 109.875 176.3 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.544 ' HA ' HG22 ' A' ' 91' ' ' VAL . . . -70.26 96.84 1.15 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.712 0.805 . . . . 0.0 109.482 167.173 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -64.18 -17.23 63.32 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.867 -0.587 . . . . 0.0 111.052 163.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 100.78 122.61 4.99 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 108.409 -1.876 . . . . 0.0 108.409 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 60.35 -7.14 0.08 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.067 1.747 . . . . 0.0 113.614 -161.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.07 146.29 36.96 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 128.148 2.579 . . . . 0.0 107.861 178.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.544 HG22 ' HA ' ' A' ' 86' ' ' ALA . 41.2 t -132.82 114.32 21.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 172.578 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.421 ' N ' HD12 ' A' ' 92' ' ' ILE . 2.8 mp -79.71 105.25 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 N-CA-C 104.544 -2.391 . . . . 0.0 104.544 171.455 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 2.9 mt -77.32 142.09 14.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 106.359 -1.719 . . . . 0.0 106.359 169.149 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.491 ' HE3' ' CE2' ' A' ' 68' ' ' TYR . 88.6 mttt -132.13 123.52 27.28 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.904 1.281 . . . . 0.0 108.615 171.627 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.54 ' HB3' HG23 ' A' ' 82' ' ' ILE . 43.7 p90 -142.22 166.76 23.81 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.901 -1.124 . . . . 0.0 111.126 -176.037 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.4 t -154.19 175.83 13.0 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 124.523 1.129 . . . . 0.0 109.259 -172.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 93.2 p -119.78 3.84 11.06 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.273 1.029 . . . . 0.0 111.811 166.037 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -137.85 141.64 40.75 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 157.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -50.7 -42.47 57.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.56 1.144 . . . . 0.0 109.972 174.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -95.04 24.82 4.57 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 129.066 2.946 . . . . 0.0 113.454 -173.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 67.7 p -126.74 159.12 34.66 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.793 1.633 . . . . 0.0 109.359 170.017 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -64.87 130.26 42.79 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 121.372 -0.83 . . . . 0.0 110.019 -174.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.45 152.38 34.52 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.243 1.817 . . . . 0.0 110.815 177.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -73.75 174.88 7.79 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.919 1.688 . . . . 0.0 109.804 168.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -119.24 132.33 55.91 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.049 1.339 . . . . 0.0 109.145 168.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.01 130.41 17.71 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 167.706 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -140.53 92.16 2.49 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 119.829 1.195 . . . . 0.0 109.586 -167.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.05 166.45 11.23 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.045 0.938 . . . . 0.0 109.203 -174.294 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 42.0 p -84.93 161.99 19.61 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 123.088 0.555 . . . . 0.0 112.043 177.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.8 mt -57.78 -40.1 79.02 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 174.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.45 -37.0 82.3 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 116.238 -1.839 . . . . 0.0 111.554 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.28 -63.83 1.0 Allowed 'General case' 0 C--N 1.347 0.496 0 CA-C-N 121.64 2.018 . . . . 0.0 110.746 169.279 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 29.2 mt -55.84 -34.36 65.34 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.214 0.531 . . . . 0.0 110.893 -175.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -71.17 -40.4 71.31 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.148 0.579 . . . . 0.0 111.174 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.77 -14.64 61.58 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 124.646 1.178 . . . . 0.0 112.236 176.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -101.08 -41.76 6.64 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 123.456 0.703 . . . . 0.0 110.227 -173.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -130.98 -0.5 4.17 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -168.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.476 ' C ' HE22 ' A' ' 123' ' ' GLN . 4.4 t80 -136.11 54.77 1.88 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 122.912 1.339 . . . . 0.0 110.617 -176.435 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -88.25 -59.04 2.35 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 127.561 2.344 . . . . 0.0 114.728 174.731 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.9 p -77.57 -166.96 0.84 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.882 1.673 . . . . 0.0 111.886 -164.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.24 -51.16 3.01 Favored 'General case' 0 CA--C 1.522 -0.103 0 C-N-CA 124.701 1.201 . . . . 0.0 108.604 -178.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.6 t -57.65 -30.44 65.41 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.262 1.825 . . . . 0.0 112.041 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.476 HE22 ' C ' ' A' ' 118' ' ' TYR . 10.5 pt20 -53.68 -32.4 51.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.668 1.576 . . . . 0.0 111.559 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -68.37 0.42 3.92 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 125.108 1.363 . . . . 0.0 112.361 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -108.78 0.19 20.28 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.566 1.546 . . . . 0.0 111.325 175.315 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -121.4 -64.7 1.2 Allowed 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 125.538 1.535 . . . . 0.0 107.478 173.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 21.9 t -52.23 -47.31 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.468 1.507 . . . . 0.0 111.056 -178.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -67.94 -32.31 72.66 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.35 0.871 . . . . 0.0 113.35 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -75.97 -35.02 59.81 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 126.672 1.989 . . . . 0.0 110.594 -172.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -60.89 -33.96 73.92 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 127.678 2.391 . . . . 0.0 111.172 171.394 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 52.7 t -66.37 -22.24 29.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 O-C-N 121.317 -0.865 . . . . 0.0 110.689 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -98.04 -12.26 22.08 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.611 1.164 . . . . 0.0 112.413 171.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.6 12.1 66.35 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 125.402 1.477 . . . . 0.0 112.414 178.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.9 pp -119.28 177.27 4.96 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.886 1.674 . . . . 0.0 109.405 174.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -130.65 176.03 8.52 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 127.029 2.132 . . . . 0.0 108.754 -168.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -133.69 -0.67 3.15 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.368 0.985 . . . . 0.0 113.087 -175.491 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.252 1.197 0 C-N-CA 127.763 2.425 . . . . 0.0 107.104 -155.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 . . . . . 0 N--CA 1.469 0.489 0 CA-C-O 121.199 0.523 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.2 p -110.96 149.64 30.38 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 120.953 -1.092 . . . . 0.0 109.458 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -54.71 -31.02 57.55 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.381 1.472 . . . . 0.0 111.335 -176.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -59.87 -60.1 4.37 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 129.369 3.067 . . . . 0.0 110.742 174.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -69.59 -36.44 76.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.623 1.569 . . . . 0.0 109.473 -172.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 82.9 mt -62.34 -39.49 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.648 0.779 . . . . 0.0 109.131 170.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.21 -55.13 25.87 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 124.747 1.165 . . . . 0.0 111.879 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 50.5 t -61.44 -41.88 91.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.311 1.055 . . . . 0.0 110.51 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.1 mt -62.14 -49.27 76.53 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 118.818 0.735 . . . . 0.0 111.055 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.53 93.2 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.429 0.292 . . . . 0.0 110.967 175.25 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.85 -32.91 85.75 Favored Glycine 0 C--O 1.222 -0.654 0 CA-C-O 119.07 -0.85 . . . . 0.0 111.634 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.533 HD12 HD21 ' A' ' 41' ' ' LEU . 7.2 mp -65.57 -30.48 71.22 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 120.342 2.071 . . . . 0.0 112.496 177.255 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.16 -26.17 68.41 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 118.916 -0.564 . . . . 0.0 111.384 175.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.403 HG21 ' HB3' ' A' ' 95' ' ' TYR . 44.6 mm -131.18 99.93 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 C-N-CA 126.208 1.803 . . . . 0.0 106.854 -165.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.278 1.5 p 57.24 56.32 7.77 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.808 174.086 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -59.14 -38.33 87.15 Favored 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 123.82 3.014 . . . . 0.0 110.185 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -63.14 -46.08 88.92 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 123.997 0.919 . . . . 0.0 110.906 -176.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -57.19 -46.1 83.13 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 172.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.533 HD21 HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -63.21 -50.35 70.63 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 106.463 -1.681 . . . . 0.0 106.463 -172.018 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -63.53 -40.33 96.76 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 125.372 1.469 . . . . 0.0 111.565 -178.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -57.06 -40.48 76.91 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.948 1.249 . . . . 0.0 110.603 175.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -81.03 -39.12 26.32 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 117.2 -1.381 . . . . 0.0 111.141 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 28.3 mm -57.45 -47.0 85.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 121.207 1.821 . . . . 0.0 108.73 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.69 -5.86 9.78 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -176.26 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.68 15.63 8.75 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.377 1.471 . . . . 0.0 112.495 173.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 66.44 6.7 4.5 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.043 1.737 . . . . 0.0 113.985 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.64 -13.67 56.07 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 120.446 -1.409 . . . . 0.0 112.235 -159.403 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.92 114.97 27.84 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.704 0.684 . . . . 0.0 110.728 -158.468 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 38.3 t -95.96 164.46 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 125.137 1.375 . . . . 0.0 108.601 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -143.49 138.28 29.11 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 128.977 2.911 . . . . 0.0 105.343 -176.42 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -157.68 177.58 34.4 Favored Glycine 0 C--N 1.333 0.407 0 CA-C-N 118.313 0.506 . . . . 0.0 112.346 173.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 15.7 mm -101.4 140.17 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.15 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 164.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.0 t -44.46 -64.54 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 C-N-CA 127.204 2.201 . . . . 0.0 111.469 176.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.4 mttt 57.57 165.53 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.065 1.746 . . . . 0.0 112.037 -170.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -76.69 -11.39 18.5 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 121.714 1.609 . . . . 0.0 112.832 176.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.3 m -97.12 23.93 6.85 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.423 1.489 . . . . 0.0 112.788 -163.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -139.94 -164.88 1.78 Allowed 'General case' 0 C--O 1.241 0.607 0 C-N-CA 127.176 2.191 . . . . 0.0 106.653 176.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 24.8 m -125.45 98.02 5.43 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 120.472 -1.392 . . . . 0.0 109.525 -166.402 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.2 m -137.57 157.73 73.21 Favored Pre-proline 0 C--O 1.241 0.645 0 C-N-CA 124.002 0.921 . . . . 0.0 113.054 -166.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.3 171.26 10.65 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.621 2.881 . . . . 0.0 110.602 171.482 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.32 158.19 34.43 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 121.594 -0.691 . . . . 0.0 111.735 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.49 31.32 63.26 Favored Glycine 0 CA--C 1.526 0.744 0 C-N-CA 124.009 0.814 . . . . 0.0 113.01 167.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.6 m -132.94 26.03 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 124.552 1.141 . . . . 0.0 110.317 174.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.97 -10.79 23.46 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 -154.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -151.39 31.76 0.59 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.863 2.065 . . . . 0.0 108.58 174.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -75.11 153.24 38.39 Favored 'General case' 0 C--O 1.232 0.151 0 O-C-N 120.919 -1.113 . . . . 0.0 108.49 173.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.2 m -72.83 154.48 40.6 Favored 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 123.712 0.805 . . . . 0.0 109.014 156.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -138.48 165.95 25.52 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.594 1.158 . . . . 0.0 109.823 167.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.3 mt -140.47 125.78 18.78 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 127.288 2.235 . . . . 0.0 105.504 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -148.23 150.94 13.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 174.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.66 159.26 17.21 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.784 0.802 . . . . 0.0 109.976 178.399 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.08 -18.03 63.94 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.199 1.0 . . . . 0.0 113.255 -168.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -102.97 -32.25 9.83 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 123.305 0.642 . . . . 0.0 111.536 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.97 9.65 0.52 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 129.038 2.935 . . . . 0.0 112.65 -176.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -56.41 -26.11 52.29 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.611 1.55 . . . . 0.0 113.618 -158.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.83 -5.88 19.43 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.695 1.589 . . . . 0.0 113.66 174.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.53 -93.64 0.88 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.852 1.215 . . . . 0.0 111.75 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.95 171.05 9.56 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.549 0.74 . . . . 0.0 110.133 -170.7 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tt -173.58 158.65 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 126.494 1.918 . . . . 0.0 106.944 162.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.425 HG23 ' HB3' ' A' ' 95' ' ' TYR . 22.8 mt -134.86 142.53 40.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 166.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -115.38 154.34 29.38 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.974 1.31 . . . . 0.0 108.541 174.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -158.65 148.1 19.19 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 125.349 1.459 . . . . 0.0 108.252 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -140.48 138.17 34.42 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 168.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -89.52 134.96 33.87 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 172.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -130.29 88.15 2.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 127.248 2.219 . . . . 0.0 108.658 174.179 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.69 -82.5 0.3 Allowed Glycine 0 C--N 1.336 0.541 0 C-N-CA 125.235 1.398 . . . . 0.0 113.078 170.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -123.79 9.93 8.91 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 126.815 2.046 . . . . 0.0 110.95 178.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.7 m -124.14 157.11 35.44 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.324 2.25 . . . . 0.0 108.51 -179.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 80.8 t -132.44 128.51 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.73 2.012 . . . . 0.0 105.882 168.181 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 20.1 mm -102.35 98.94 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 105.267 -2.123 . . . . 0.0 105.267 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.3 mt -83.44 130.67 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -134.53 91.26 2.76 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.879 1.672 . . . . 0.0 108.606 -175.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.425 ' HB3' HG23 ' A' ' 82' ' ' ILE . 31.0 p90 -108.48 170.36 8.07 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.807 -1.183 . . . . 0.0 111.645 -173.77 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.4 t -159.01 173.72 16.04 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.899 1.28 . . . . 0.0 110.152 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.9 m -121.7 12.9 10.72 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.08 2.552 . . . . 0.0 111.485 167.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -144.27 127.11 16.29 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 160.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -49.22 -39.34 29.52 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.593 0.757 . . . . 0.0 110.712 170.119 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -82.75 31.41 0.42 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.155 1.782 . . . . 0.0 113.628 -177.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 45.6 p -139.22 163.36 32.67 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 119.519 -1.988 . . . . 0.0 112.741 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.541 ' HE3' ' HA ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -58.44 153.92 14.87 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.611 1.164 . . . . 0.0 110.028 169.387 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -105.54 156.17 18.48 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.259 1.424 . . . . 0.0 110.789 -169.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.17 179.04 1.66 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.834 1.254 . . . . 0.0 112.0 173.658 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -123.07 124.9 44.14 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.707 1.203 . . . . 0.0 109.413 168.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -144.76 105.95 4.2 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 103.911 -2.625 . . . . 0.0 103.911 168.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -118.05 109.34 16.33 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -172.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 27.0 mt -125.14 144.56 50.37 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -166.399 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 15.9 p -68.52 151.7 46.41 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.952 0.796 . . . . 0.0 109.834 172.245 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 26.8 mt -55.72 -36.0 66.75 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.426 -0.796 . . . . 0.0 111.211 168.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.4 t -61.53 -44.52 96.9 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.021 173.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.83 -60.81 2.85 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.411 1.085 . . . . 0.0 109.891 178.436 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 48.0 mt -55.91 -33.52 64.74 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 123.07 0.548 . . . . 0.0 111.948 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 -43.9 77.28 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.665 -0.647 . . . . 0.0 109.29 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -25.21 61.46 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.665 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.72 -66.61 0.61 Allowed 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 169.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -117.22 22.98 12.15 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.851 -1.156 . . . . 0.0 112.763 -158.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -151.06 26.55 0.71 Allowed 'General case' 0 C--O 1.239 0.542 0 O-C-N 120.744 -1.223 . . . . 0.0 112.632 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.24 -59.62 3.27 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -172.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 17.9 p -77.81 172.03 14.07 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.016 1.327 . . . . 0.0 110.812 -171.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.83 -50.12 8.4 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 171.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -41.21 63.41 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.514 1.126 . . . . 0.0 110.92 -176.12 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -48.17 -45.57 33.67 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.734 1.214 . . . . 0.0 111.497 178.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -59.34 -20.37 54.1 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.795 1.638 . . . . 0.0 113.49 -169.196 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -55.0 -70.7 0.1 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 170.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -57.57 -41.97 82.14 Favored 'General case' 0 C--O 1.222 -0.373 0 O-C-N 123.769 0.668 . . . . 0.0 111.467 -174.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 17.7 t -54.21 -59.0 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 O-C-N 123.919 0.762 . . . . 0.0 109.794 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -57.47 -34.04 68.61 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 123.169 0.293 . . . . 0.0 111.238 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -64.52 -42.15 95.95 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.961 1.304 . . . . 0.0 110.958 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -58.78 -45.76 89.1 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.032 -1.043 . . . . 0.0 109.837 171.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 19.0 t -64.74 -31.1 52.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 O-C-N 121.844 -0.535 . . . . 0.0 110.89 179.1 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -84.84 -15.03 46.13 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.452 1.101 . . . . 0.0 113.181 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -96.94 -32.6 6.41 Favored Glycine 0 C--N 1.334 0.421 0 C-N-CA 124.123 0.868 . . . . 0.0 111.808 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.56 151.52 20.31 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.087 0.944 . . . . 0.0 112.177 -173.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 56.6 mtp85 -92.37 153.26 19.29 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 174.123 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 m -131.19 25.37 4.89 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.846 1.258 . . . . 0.0 109.635 173.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.917 2.887 . . . . 0.0 110.949 -164.141 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 . . . . . 0 CA--C 1.543 0.695 0 CA-C-O 121.684 0.754 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -122.35 152.69 39.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.548 1.539 . . . . 0.0 109.534 -175.362 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.59 -55.62 5.03 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 125.707 1.603 . . . . 0.0 111.354 177.039 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -44.91 -63.21 0.97 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.651 1.58 . . . . 0.0 110.359 174.653 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.404 ' NE2' HG11 ' A' ' 131' ' ' VAL . 69.7 mm-40 -54.65 -59.64 4.43 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.108 0.963 . . . . 0.0 109.241 -176.234 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 35.8 mt -56.91 -34.63 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 125.438 1.495 . . . . 0.0 110.395 -170.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.56 -28.38 71.26 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 117.958 -1.468 . . . . 0.0 114.065 -178.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 72.4 t -71.95 -40.71 68.43 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.183 0 CA-C-N 119.027 1.414 . . . . 0.0 108.635 177.466 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.89 -43.8 97.83 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.218 0.607 . . . . 0.0 109.71 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.88 -43.58 95.61 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.081 -0.387 . . . . 0.0 110.931 174.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.39 -30.21 75.0 Favored Glycine 0 C--O 1.222 -0.604 0 N-CA-C 110.633 -0.987 . . . . 0.0 110.633 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.9 tp -69.33 -24.0 63.86 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 120.49 -1.594 . . . . 0.0 112.018 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.85 -21.46 62.42 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.849 -0.596 . . . . 0.0 111.793 170.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.441 HD12 ' CE2' ' A' ' 95' ' ' TYR . 28.7 mm -135.52 92.89 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 C-N-CA 126.261 1.824 . . . . 0.0 107.539 -158.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 74.7 m 60.2 54.91 4.05 Favored Pre-proline 0 CA--C 1.553 1.063 0 O-C-N 121.348 -0.845 . . . . 0.0 112.176 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -60.03 -38.15 79.88 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.968 3.112 . . . . 0.0 111.796 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -55.71 -52.65 63.15 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.699 1.199 . . . . 0.0 109.68 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -61.43 -38.26 86.52 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.684 1.194 . . . . 0.0 111.054 177.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -52.89 58.17 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -62.38 -43.16 99.48 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.866 0.866 . . . . 0.0 111.743 -175.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -61.25 -44.0 97.96 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 119.248 0.931 . . . . 0.0 110.045 -176.153 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -69.64 -35.89 75.6 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 117.289 -1.339 . . . . 0.0 112.422 -176.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.9 mm -56.5 -53.67 37.94 Favored 'Isoleucine or valine' 0 C--N 1.339 0.149 0 CA-C-N 119.215 0.916 . . . . 0.0 109.469 168.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.75 -21.7 66.06 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -177.124 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.95 -8.13 58.87 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 126.752 2.021 . . . . 0.0 113.663 169.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 44.89 43.55 7.15 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.238 2.215 . . . . 0.0 110.531 -169.516 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -103.53 -2.13 27.26 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.407 2.283 . . . . 0.0 115.06 -177.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.13 135.06 44.38 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.011 1.324 . . . . 0.0 110.664 -160.049 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 71.7 t -120.4 117.45 53.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 124.462 1.105 . . . . 0.0 108.041 -175.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.462 ' CD2' HG23 ' A' ' 136' ' ' THR . 23.3 t80 -80.76 152.64 28.21 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.604 1.562 . . . . 0.0 108.357 163.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -173.79 165.32 37.11 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 171.158 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 36.1 mm -104.06 141.7 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 170.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.57 HG13 HG11 ' A' ' 61' ' ' VAL . 24.1 t -44.23 -71.66 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 127.322 2.249 . . . . 0.0 114.43 -171.044 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.1 mptt 55.77 165.8 0.06 OUTLIER Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 125.281 1.432 . . . . 0.0 113.777 -169.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.64 -4.39 14.52 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.11 2.54 . . . . 0.0 113.86 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.32 -70.37 0.1 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.127 2.171 . . . . 0.0 112.388 -174.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.5 171.39 13.43 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.124 0.97 . . . . 0.0 109.042 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -66.04 142.03 57.95 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 165.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.57 HG11 HG13 ' A' ' 55' ' ' VAL . 0.3 OUTLIER -152.62 158.27 33.29 Favored Pre-proline 0 C--O 1.242 0.67 0 C-N-CA 123.658 0.783 . . . . 0.0 110.176 169.223 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.88 178.79 3.7 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 124.34 3.36 . . . . 0.0 111.197 166.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -76.2 167.78 21.24 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.346 -0.846 . . . . 0.0 111.391 178.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.44 18.72 77.18 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 118.603 -1.11 . . . . 0.0 114.402 165.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.2 m -130.24 21.88 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 118.764 1.282 . . . . 0.0 112.402 -174.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.74 -17.27 3.26 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 118.43 2.752 . . . . 0.0 118.43 -162.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -149.57 18.91 0.93 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 127.237 2.215 . . . . 0.0 109.195 -174.403 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.442 ' CD1' ' HG3' ' A' ' 85' ' ' LYS . 3.1 m-85 -69.7 148.86 48.69 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 171.603 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.0 t -67.23 161.56 24.59 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 155.63 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -141.99 141.92 32.91 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.814 161.217 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.1 133.75 52.88 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 172.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.7 p -156.79 149.96 10.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 174.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.25 170.32 15.8 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.709 1.14 . . . . 0.0 109.578 173.545 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.66 -29.98 63.89 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 122.134 0.968 . . . . 0.0 112.239 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -90.96 -37.61 13.38 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 127.51 2.324 . . . . 0.0 111.889 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . 0.279 0.0 OUTLIER -91.59 30.37 1.34 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.346 0.975 . . . . 0.0 111.859 -169.536 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -45.57 -53.98 8.27 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.51 1.124 . . . . 0.0 112.878 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -86.75 6.34 31.91 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.817 1.247 . . . . 0.0 112.537 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -92.17 -106.42 1.59 Allowed Glycine 0 CA--C 1.525 0.707 0 C-N-CA 126.68 2.086 . . . . 0.0 110.91 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 39.9 m -90.0 153.61 20.46 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.261 1.425 . . . . 0.0 108.893 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tt -153.62 146.25 14.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 O-C-N 120.14 -1.6 . . . . 0.0 108.777 162.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mt -128.39 113.05 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 178.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -90.77 143.43 26.73 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -148.6 160.18 43.36 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.983 -1.073 . . . . 0.0 111.612 170.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.442 ' HG3' ' CD1' ' A' ' 68' ' ' TYR . 1.3 tmtt? -148.91 129.37 13.9 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.073 0.949 . . . . 0.0 108.951 171.542 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ALA . . . . . 0.424 ' HA ' HG22 ' A' ' 91' ' ' VAL . . . -104.82 115.27 30.02 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 124.053 0.941 . . . . 0.0 110.09 -174.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -126.41 99.24 5.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.403 2.281 . . . . 0.0 108.512 -165.225 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 67.21 -83.13 0.13 Allowed Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.747 1.165 . . . . 0.0 114.821 173.117 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -133.78 20.82 3.86 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.242 2.217 . . . . 0.0 110.752 176.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.2 146.63 45.12 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.376 1.87 . . . . 0.0 109.022 -174.184 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' VAL . . . . . 0.424 HG22 ' HA ' ' A' ' 86' ' ' ALA . 96.8 t -131.72 124.53 54.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 169.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.468 ' N ' HD12 ' A' ' 92' ' ' ILE . 2.8 mp -93.04 101.47 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 105.094 -2.187 . . . . 0.0 105.094 177.331 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.5 mt -92.67 121.13 43.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -121.13 96.05 4.94 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 126.742 2.017 . . . . 0.0 107.4 -175.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.441 ' CE2' HD12 ' A' ' 36' ' ' ILE . 34.5 p90 -113.45 168.26 9.9 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.386 -1.446 . . . . 0.0 111.421 -174.445 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.1 t -155.44 179.39 9.22 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.844 1.658 . . . . 0.0 107.195 177.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.2 p -122.19 2.4 9.79 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 127.056 2.143 . . . . 0.0 110.019 171.412 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -139.84 131.76 27.7 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-O 121.117 0.484 . . . . 0.0 111.363 164.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -3.26 3.8 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 128.486 2.715 . . . . 0.0 112.994 177.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -122.59 33.06 5.54 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.546 1.538 . . . . 0.0 110.264 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.4 p -130.43 -164.43 1.42 Allowed 'General case' 0 CA--C 1.546 0.809 0 O-C-N 120.686 -1.259 . . . . 0.0 112.695 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -100.58 154.28 18.7 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.231 1.413 . . . . 0.0 108.481 169.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -89.46 158.2 17.81 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.845 0.858 . . . . 0.0 110.354 -172.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -67.36 -178.91 0.92 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.443 1.097 . . . . 0.0 109.154 160.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -140.68 97.82 3.28 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -97.08 160.89 14.08 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 155.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -156.13 91.03 1.24 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.624 1.17 . . . . 0.0 107.857 169.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -96.34 163.45 13.07 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.611 0.764 . . . . 0.0 109.562 -178.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 40.9 p -81.46 163.01 23.05 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 166.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.37 -43.15 78.92 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 123.637 0.775 . . . . 0.0 109.007 169.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.79 -39.71 95.08 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.369 -0.824 . . . . 0.0 111.583 -176.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.8 -65.74 0.51 Allowed 'General case' 0 C--N 1.345 0.41 0 CA-C-O 118.537 -0.744 . . . . 0.0 109.321 168.302 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 93.9 mt -54.73 -30.74 57.03 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.221 1.009 . . . . 0.0 112.304 -174.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 59.7 tttt -66.31 -46.74 75.88 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 -7.69 58.83 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 124.609 1.163 . . . . 0.0 113.097 178.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -73.01 -66.13 0.71 Allowed 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 160.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -130.06 11.48 5.54 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 120.537 -1.352 . . . . 0.0 113.918 -154.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' TYR . . . . . 0.482 ' CZ ' ' HE2' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -140.65 22.48 2.32 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 120.796 -1.19 . . . . 0.0 111.622 179.324 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.77 -45.55 51.04 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 105.097 -2.186 . . . . 0.0 105.097 -163.19 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.8 t -91.52 150.83 21.02 Favored 'General case' 0 C--N 1.352 0.674 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -74.51 -20.34 60.01 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-O 117.327 -1.32 . . . . 0.0 112.257 177.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 4.2 t -81.24 -32.4 33.38 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 120.212 1.369 . . . . 0.0 110.932 -178.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -62.29 -26.77 68.59 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.981 1.264 . . . . 0.0 111.405 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.482 ' HE2' ' CZ ' ' A' ' 118' ' ' TYR . 2.6 mtpm? -47.87 -29.61 3.42 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 125.986 1.714 . . . . 0.0 113.463 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -52.67 -59.38 4.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.482 1.513 . . . . 0.0 110.26 175.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.73 -49.89 66.79 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 125.478 1.511 . . . . 0.0 110.013 -177.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 13.6 t -54.4 -54.85 18.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.405 -178.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -65.07 -25.62 67.88 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 178.217 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -65.41 -34.75 79.04 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.704 172.091 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -66.08 -34.82 78.94 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 119.963 1.256 . . . . 0.0 111.098 173.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.404 HG11 ' NE2' ' A' ' 27' ' ' GLN . 18.2 t -73.41 -12.01 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 O-C-N 121.558 -0.714 . . . . 0.0 111.136 177.633 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -121.34 22.14 10.88 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.491 1.517 . . . . 0.0 111.951 -176.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -132.86 -0.13 4.39 Favored Glycine 0 CA--C 1.528 0.9 0 O-C-N 120.876 -1.14 . . . . 0.0 112.684 174.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -76.26 -178.09 4.35 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 125.913 1.685 . . . . 0.0 111.632 173.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.1 mtt-85 -130.62 166.43 20.69 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 126.33 1.852 . . . . 0.0 107.013 164.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' THR . . . . . 0.462 HG23 ' CD2' ' A' ' 52' ' ' TYR . 2.3 m -122.73 -0.51 9.1 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 124.295 1.038 . . . . 0.0 111.013 177.199 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 C--O 1.246 0.884 0 CA-C-O 115.198 -2.334 . . . . 0.0 107.595 -149.151 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.811 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 45.0 28.36 0.36 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.988 1.715 . . . . 0.0 113.967 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 14.6 ptt? -96.26 -164.38 1.15 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.305 1.842 . . . . 0.0 110.794 -165.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -131.91 -178.94 5.11 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 161.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 58.41 -173.26 0.09 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.061 1.745 . . . . 0.0 109.173 -175.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 p -131.22 152.39 50.55 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.182 1.393 . . . . 0.0 107.29 168.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -59.33 -42.89 92.53 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 124.357 1.063 . . . . 0.0 109.769 -173.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -45.12 -47.64 12.12 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.019 1.728 . . . . 0.0 111.998 172.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -73.84 -28.71 61.74 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.685 1.194 . . . . 0.0 111.846 -174.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 71.4 mt -83.15 -34.12 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 125.018 1.327 . . . . 0.0 110.11 -176.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.59 -36.78 93.7 Favored Glycine 0 C--N 1.336 0.538 0 CA-C-N 118.997 0.817 . . . . 0.0 112.157 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.7 t -56.81 -47.8 82.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 CA-C-N 117.474 0.637 . . . . 0.0 109.972 175.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 mp -60.02 -46.77 88.39 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.688 0.676 . . . . 0.0 109.27 177.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.7 -25.5 68.23 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.89 -24.31 10.77 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 119.059 0.845 . . . . 0.0 112.225 176.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mp -62.68 -28.14 69.73 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.067 1.933 . . . . 0.0 110.391 165.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.59 -24.0 61.03 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.094 1.358 . . . . 0.0 113.289 172.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.7 mm -142.38 93.12 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 125.255 1.422 . . . . 0.0 107.428 -166.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.83 65.49 1.0 Allowed Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 125.783 1.633 . . . . 0.0 111.282 -176.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -60.98 -33.28 92.54 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.3 2.667 . . . . 0.0 111.643 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -71.25 -40.86 70.75 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.582 0.753 . . . . 0.0 109.343 -176.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.401 ' HA ' ' HG2' ' A' ' 43' ' ' GLN . 44.7 t90 -64.54 -37.52 87.84 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 121.985 -0.447 . . . . 0.0 111.22 173.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.78 -49.86 76.06 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 120.998 -1.064 . . . . 0.0 108.682 173.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -59.62 -48.04 83.22 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 116.879 -1.534 . . . . 0.0 113.161 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.401 ' HG2' ' HA ' ' A' ' 40' ' ' TRP . 0.0 OUTLIER -57.63 -38.95 75.86 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.167 1.349 . . . . 0.0 111.157 -176.052 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -75.64 -48.5 21.87 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.65 1.18 . . . . 0.0 110.732 -176.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.3 mm -59.62 -32.03 48.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 119.419 1.009 . . . . 0.0 111.151 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.7 -39.04 70.48 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.458 1.026 . . . . 0.0 111.329 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -110.11 19.81 18.56 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.851 1.26 . . . . 0.0 111.758 176.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.78 14.54 3.27 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 120.247 -1.533 . . . . 0.0 113.808 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -69.94 -6.61 34.22 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.529 1.932 . . . . 0.0 113.422 -171.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.3 tp -86.01 131.01 34.37 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.086 1.354 . . . . 0.0 108.275 -172.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 98.8 t -106.44 131.07 57.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 171.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -94.09 116.36 28.77 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 161.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -144.3 164.06 27.7 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 171.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 22.8 mm -101.62 140.99 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -177.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.549 HG13 HG11 ' A' ' 61' ' ' VAL . 31.1 t -51.7 -73.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 125.876 1.67 . . . . 0.0 110.927 175.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? 56.62 166.01 0.06 OUTLIER Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 125.728 1.611 . . . . 0.0 112.84 -168.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -70.34 75.85 1.42 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 121.746 1.631 . . . . 0.0 109.061 160.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.1 t -130.51 -56.02 1.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.053 1.341 . . . . 0.0 110.986 -167.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -130.46 176.14 8.39 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.194 0.998 . . . . 0.0 108.625 -171.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.5 m -57.92 113.95 2.11 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.594 0.758 . . . . 0.0 109.814 171.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.549 HG11 HG13 ' A' ' 55' ' ' VAL . 6.1 m -137.98 159.34 68.89 Favored Pre-proline 0 C--O 1.239 0.521 0 O-C-N 121.965 -0.459 . . . . 0.0 110.236 174.264 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -72.26 175.64 9.68 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 123.578 2.852 . . . . 0.0 111.475 169.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.26 152.19 43.53 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 123.867 0.867 . . . . 0.0 111.34 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.65 28.93 33.87 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.856 -0.969 . . . . 0.0 114.483 162.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.0 m -140.52 28.68 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 124.405 1.082 . . . . 0.0 111.203 -174.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -64.0 -16.16 60.99 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 -153.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -151.51 29.14 0.62 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 127.609 2.363 . . . . 0.0 108.496 173.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -71.46 148.31 46.97 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 172.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.432 ' HB2' ' CE1' ' A' ' 84' ' ' PHE . 0.0 OUTLIER -77.97 142.49 38.29 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 166.01 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -128.06 135.31 49.66 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.874 0.87 . . . . 0.0 109.412 170.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.23 131.39 46.2 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 172.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.422 ' HB ' HG13 ' A' ' 81' ' ' ILE . 7.5 p -151.39 166.66 1.95 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 172.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.4 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -95.01 156.26 16.39 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 165.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.41 -16.14 53.21 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -113.21 -2.01 14.2 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.77 1.228 . . . . 0.0 111.978 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.4 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 31.6 m-20 -110.43 22.77 15.09 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.373 1.069 . . . . 0.0 110.08 -170.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -44.88 -63.95 0.81 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.267 1.027 . . . . 0.0 111.154 -174.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -82.75 -16.65 47.16 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.796 0.438 . . . . 0.0 110.196 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -54.76 -80.22 0.08 OUTLIER Glycine 0 CA--C 1.527 0.81 0 C-N-CA 127.994 2.711 . . . . 0.0 113.82 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -148.45 148.78 30.66 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.208 1.004 . . . . 0.0 108.683 -176.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.422 HG13 ' HB ' ' A' ' 72' ' ' VAL . 3.7 tt -150.67 148.49 15.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-N 119.175 0.898 . . . . 0.0 109.225 -177.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 50.1 mt -134.85 110.01 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 N-CA-C 107.823 -1.176 . . . . 0.0 107.823 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -85.83 146.62 26.67 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 169.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.432 ' CE1' ' HB2' ' A' ' 69' ' ' SER . 26.3 p90 -149.59 164.47 35.03 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.626 -1.296 . . . . 0.0 110.152 167.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.65 124.31 4.94 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 167.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.84 124.89 28.68 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 161.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -123.21 115.51 21.87 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 166.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 70.24 -96.77 0.56 Allowed Glycine 0 CA--C 1.523 0.575 0 C-N-CA 124.102 0.858 . . . . 0.0 112.817 175.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -136.29 21.31 3.19 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.572 1.949 . . . . 0.0 110.364 -177.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.0 m -125.97 149.28 48.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.63 1.572 . . . . 0.0 107.368 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 60.0 t -122.41 130.54 74.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.376 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 166.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.444 ' N ' HD12 ' A' ' 92' ' ' ILE . 1.1 mp -106.66 92.82 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 176.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.6 mt -77.87 129.91 36.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -131.06 98.12 4.49 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 125.535 1.534 . . . . 0.0 107.089 -174.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -124.15 164.65 19.04 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.613 -1.305 . . . . 0.0 110.461 -168.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.1 t -156.49 160.51 39.61 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.121 0.568 . . . . 0.0 109.64 174.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.9 p -108.7 8.2 26.78 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.17 1.788 . . . . 0.0 110.987 171.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -152.63 101.97 2.68 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 127.148 2.179 . . . . 0.0 106.711 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 tpt180 -44.26 -50.61 8.84 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 130.92 3.688 . . . . 0.0 110.594 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -75.35 3.5 8.94 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.0 p -119.85 165.52 14.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.849 0.356 . . . . 0.0 110.903 171.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' A' ' 103' ' ' LEU . 10.5 ptmt -65.49 173.28 2.77 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 122.669 1.223 . . . . 0.0 111.379 -177.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.412 ' O ' ' HE2' ' A' ' 102' ' ' LYS . 2.9 mm? -82.3 153.49 25.8 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.84 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.68 -179.7 1.86 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.855 0.862 . . . . 0.0 109.024 156.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -138.61 120.0 14.86 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.559 1.144 . . . . 0.0 108.211 169.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 mttm -112.08 106.27 14.86 Favored 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 158.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -84.06 135.48 34.4 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 160.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -134.48 158.17 44.62 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.774 1.63 . . . . 0.0 106.763 169.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.9 p -69.42 155.13 40.95 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.634 161.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.0 mt -58.4 -30.54 66.92 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.703 -0.623 . . . . 0.0 111.313 169.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.0 t -64.76 -44.05 91.33 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 117.323 -1.322 . . . . 0.0 111.447 173.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -57.08 10.37 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 120.053 1.297 . . . . 0.0 109.561 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 16.0 mt -58.49 -44.85 89.54 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.314 1.445 . . . . 0.0 111.156 -179.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -61.22 -38.69 87.51 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.529 -0.732 . . . . 0.0 110.944 177.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -81.74 -19.25 41.79 Favored 'General case' 0 C--O 1.223 -0.329 0 O-C-N 120.463 -1.398 . . . . 0.0 111.127 -175.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -79.03 -50.64 10.76 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.544 1.138 . . . . 0.0 111.328 171.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -123.03 18.1 10.04 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 121.16 -0.962 . . . . 0.0 112.608 -165.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.463 ' CZ ' ' HE2' ' A' ' 124' ' ' LYS . 2.9 t80 -148.39 30.99 0.83 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 120.535 -1.353 . . . . 0.0 110.066 175.09 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -63.97 -65.2 0.71 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 -176.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.5 p -75.89 175.77 8.46 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.617 0.767 . . . . 0.0 111.285 -169.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -42.38 11.98 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 121.116 -0.99 . . . . 0.0 110.235 173.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.2 m -57.77 -39.84 78.4 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-N 118.923 0.783 . . . . 0.0 111.374 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 42.7 tt0 -58.65 -25.54 62.87 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.225 1.01 . . . . 0.0 111.976 -178.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.463 ' HE2' ' CZ ' ' A' ' 118' ' ' TYR . 7.7 mtpt -63.47 -21.26 66.21 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.532 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -65.35 -64.3 0.89 Allowed 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 167.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -48.74 76.38 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 123.405 0.682 . . . . 0.0 112.254 -168.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.12 -54.04 31.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -66.13 -18.25 65.23 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -75.25 -44.08 48.01 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 125.461 1.504 . . . . 0.0 109.735 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -59.67 -32.02 70.1 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.848 0.859 . . . . 0.0 110.07 171.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 38.8 t -69.96 -20.53 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 O-C-N 120.654 -1.279 . . . . 0.0 111.977 172.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -118.39 20.98 12.88 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.92 1.288 . . . . 0.0 111.438 -173.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -134.75 18.41 4.08 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 127.315 2.388 . . . . 0.0 110.857 169.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -90.55 164.95 14.03 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 123.976 0.911 . . . . 0.0 110.151 169.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.47 165.36 11.08 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.719 1.608 . . . . 0.0 107.157 162.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -136.15 -4.96 2.12 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 124.519 1.127 . . . . 0.0 111.776 -167.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 . . . . . 0 C--O 1.247 0.931 0 C-N-CA 131.246 3.818 . . . . 0.0 102.638 -172.585 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.458 0 N-CA-C 112.005 -0.438 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 44.74 56.43 5.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 127.459 2.304 . . . . 0.0 112.608 171.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.22 146.4 27.59 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 177.134 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.12 168.61 0.14 Allowed 'General case' 0 C--O 1.238 0.49 0 C-N-CA 125.136 1.374 . . . . 0.0 109.6 -158.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -77.53 170.79 15.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -178.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 p -121.09 162.62 19.72 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 161.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -62.7 -35.13 78.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.561 0.696 . . . . 0.0 110.3 -165.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -43.3 95.27 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.486 1.115 . . . . 0.0 110.59 177.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -58.68 -47.52 84.22 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.836 0.854 . . . . 0.0 108.748 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 88.0 mt -65.07 -41.9 93.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 123.722 0.809 . . . . 0.0 109.371 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.65 -43.75 91.31 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 123.657 0.646 . . . . 0.0 112.667 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.9 t -60.76 -51.62 71.07 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 C-N-CA 123.493 0.717 . . . . 0.0 109.34 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.3 -33.39 75.4 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.532 1.06 . . . . 0.0 111.76 -175.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.1 95.23 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 122.835 0.454 . . . . 0.0 110.033 173.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.84 7.09 44.4 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-O 118.445 -1.197 . . . . 0.0 113.091 173.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -100.8 -8.9 22.23 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 119.788 1.794 . . . . 0.0 111.753 162.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -98.99 -10.03 23.21 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.157 0.983 . . . . 0.0 113.414 173.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.479 HD12 ' CE2' ' A' ' 95' ' ' TYR . 40.5 mm -139.73 93.61 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 129.684 3.194 . . . . 0.0 107.484 -172.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 63.01 73.42 0.51 Allowed Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -78.86 -30.31 2.94 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.439 2.093 . . . . 0.0 111.588 -171.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.51 -44.22 91.6 Favored 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 125.391 1.476 . . . . 0.0 109.743 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.409 ' CZ3' HD12 ' A' ' 82' ' ' ILE . 63.9 t90 -52.37 -62.54 1.58 Allowed 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 125.172 1.389 . . . . 0.0 110.093 168.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.0 tt -52.16 -51.94 54.9 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 118.704 0.684 . . . . 0.0 111.471 -175.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.1 mttm -59.25 -44.92 92.36 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.343 -0.837 . . . . 0.0 111.413 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -60.98 -45.48 94.61 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.633 1.106 . . . . 0.0 110.631 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -58.26 -42.88 87.4 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 29.6 mm -64.78 -46.11 93.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 118.741 0.7 . . . . 0.0 110.178 176.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.36 -20.27 53.41 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.618 1.099 . . . . 0.0 112.311 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -102.16 1.14 35.73 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.623 1.569 . . . . 0.0 112.623 174.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 44.95 33.96 1.14 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.497 2.319 . . . . 0.0 111.14 -170.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -88.97 -18.08 28.16 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.802 2.041 . . . . 0.0 112.976 -173.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.88 130.5 37.67 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.484 1.514 . . . . 0.0 109.458 -163.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 55.6 t -108.52 156.9 8.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-O 122.955 1.359 . . . . 0.0 108.215 172.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -126.96 138.37 53.26 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.516 2.326 . . . . 0.0 105.249 176.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -161.62 -178.84 35.89 Favored Glycine 0 N--CA 1.445 -0.724 0 CA-C-O 122.241 0.912 . . . . 0.0 112.428 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.4 mm -124.48 134.85 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 C-N-CA 129.161 2.984 . . . . 0.0 104.73 -173.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.487 HG13 HG21 ' A' ' 61' ' ' VAL . 21.3 t -44.73 -53.96 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 C-N-CA 124.104 0.962 . . . . 0.0 113.287 -176.299 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.9 mmtt 65.16 156.31 0.12 Allowed Pre-proline 0 CA--C 1.532 0.257 0 C-N-CA 129.213 3.005 . . . . 0.0 111.09 -171.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.96 -3.11 7.74 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 124.103 3.202 . . . . 0.0 113.897 -176.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -120.02 -2.41 10.25 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.796 -1.19 . . . . 0.0 113.904 -162.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -89.58 173.01 8.55 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 120.814 1.643 . . . . 0.0 113.471 -170.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.6 t -76.33 35.75 0.15 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 129.51 3.124 . . . . 0.0 112.682 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.487 HG21 HG13 ' A' ' 55' ' ' VAL . 2.5 m -90.33 151.87 45.0 Favored Pre-proline 0 CA--C 1.536 0.441 0 O-C-N 120.675 -1.266 . . . . 0.0 113.502 -163.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.0 158.11 56.21 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.398 2.732 . . . . 0.0 110.278 176.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.93 144.27 56.33 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 123.393 0.677 . . . . 0.0 109.479 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.85 20.89 45.04 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-N 119.164 0.893 . . . . 0.0 113.429 176.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.4 m -140.29 90.81 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 104.308 -2.479 . . . . 0.0 104.308 166.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -92.42 -15.89 26.61 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -169.7 46.37 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.999 1.72 . . . . 0.0 110.956 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.401 ' O ' HG23 ' A' ' 55' ' ' VAL . 4.9 m-85 -94.9 114.96 26.87 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 162.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.83 154.41 7.18 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.439 1.018 . . . . 0.0 110.424 173.067 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 38.7 p90 -130.78 153.74 48.74 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.326 0.651 . . . . 0.0 110.447 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -119.1 134.45 55.19 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 126.767 2.027 . . . . 0.0 106.573 170.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.6 p -147.89 158.42 8.38 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 N-CA-C 104.722 -2.325 . . . . 0.0 104.722 171.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.75 164.6 17.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.931 1.241 . . . . 0.0 107.905 168.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.63 0.4 26.6 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 121.354 -0.841 . . . . 0.0 112.807 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -137.87 4.03 2.51 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.492 1.042 . . . . 0.0 112.678 -168.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -128.31 34.0 4.62 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.483 1.913 . . . . 0.0 109.569 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -56.79 -13.38 2.51 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -163.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.42 7.06 7.67 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 121.064 1.756 . . . . 0.0 111.893 174.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -82.38 -71.28 1.31 Allowed Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 126.494 1.997 . . . . 0.0 110.065 -178.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.8 m -118.79 171.13 8.43 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 117.981 0.891 . . . . 0.0 109.462 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.0 tt -168.32 148.52 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.521 0 C-N-CA 126.958 2.103 . . . . 0.0 106.945 158.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.409 HD12 ' CZ3' ' A' ' 40' ' ' TRP . 73.5 mt -132.58 131.2 60.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.106 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 173.137 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -105.52 151.5 24.22 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 125.583 1.553 . . . . 0.0 108.69 172.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -144.08 156.93 44.56 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.678 1.191 . . . . 0.0 108.783 170.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.401 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 18.0 tttt -144.91 134.53 23.36 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 161.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.41 123.22 21.24 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 159.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -99.09 23.16 9.38 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.013 0.925 . . . . 0.0 109.037 165.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 76.8 115.08 0.14 Allowed Glycine 0 C--N 1.34 0.772 0 C-N-CA 125.963 1.744 . . . . 0.0 110.821 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 61.54 0.77 0.5 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.718 1.607 . . . . 0.0 113.645 -173.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.41 149.78 38.13 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.556 2.342 . . . . 0.0 106.628 177.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.78 129.57 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 172.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 19.4 mm -100.09 112.96 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 174.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.5 mt -101.43 118.07 47.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.467 ' HB3' HD13 ' A' ' 103' ' ' LEU . 72.9 mttt -116.72 104.99 11.91 Favored 'General case' 0 C--O 1.223 -0.306 0 C-N-CA 126.936 2.094 . . . . 0.0 107.17 -172.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.479 ' CE2' HD12 ' A' ' 36' ' ' ILE . 40.1 p90 -125.79 169.71 12.33 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.164 -1.585 . . . . 0.0 110.761 -177.309 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.1 t -151.26 168.7 23.94 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.149 1.38 . . . . 0.0 108.317 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.9 p -88.65 -12.73 41.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.664 1.185 . . . . 0.0 113.178 167.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -150.1 137.36 19.64 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.55 0.74 . . . . 0.0 109.771 -174.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -60.14 -21.03 61.11 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.577 1.551 . . . . 0.0 112.04 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -94.47 2.4 55.73 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.6 p -121.88 156.35 33.5 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.352 0.978 . . . . 0.0 112.771 -172.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.2 tmtt? -64.4 135.62 56.3 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 124.63 1.172 . . . . 0.0 109.819 -169.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.467 HD13 ' HB3' ' A' ' 94' ' ' LYS . 83.4 mt -72.81 143.9 47.71 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 123.984 0.914 . . . . 0.0 109.763 -176.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -71.24 -171.69 0.62 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.226 1.41 . . . . 0.0 109.439 171.04 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.93 103.91 4.09 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.114 -0.991 . . . . 0.0 110.172 170.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -85.3 147.53 26.5 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 106.147 -1.797 . . . . 0.0 106.147 147.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -137.5 127.31 25.53 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 168.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.4 mt -141.67 139.26 32.94 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -168.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 16.9 p -69.28 154.64 41.71 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.319 0.963 . . . . 0.0 109.873 173.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 20.4 mt -59.45 -28.54 67.08 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.314 -0.866 . . . . 0.0 110.046 168.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.46 -29.94 65.44 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.81 -0.556 . . . . 0.0 112.329 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.11 -59.84 2.66 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 105.856 -1.905 . . . . 0.0 105.856 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.61 -37.08 72.67 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.76 1.224 . . . . 0.0 113.138 -175.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -70.57 -31.75 68.89 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.49 -0.756 . . . . 0.0 110.21 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.401 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -67.78 -63.02 1.14 Allowed 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 174.743 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -46.88 -53.55 11.89 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.315 1.446 . . . . 0.0 111.59 -173.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -119.14 11.46 12.38 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 121.827 -0.546 . . . . 0.0 111.953 -163.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -149.44 34.85 0.71 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 5.1 pm0 -81.08 -40.33 24.29 Favored 'General case' 0 C--N 1.342 0.278 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 16.6 p -89.02 -178.84 5.79 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.899 1.681 . . . . 0.0 110.543 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 -88.45 -45.41 9.98 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 120.994 -1.066 . . . . 0.0 109.314 170.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 37.3 p -66.63 -30.27 70.51 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.301 0.955 . . . . 0.0 111.213 -175.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -58.43 -30.96 67.31 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.256 0.934 . . . . 0.0 110.618 176.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -59.76 -27.22 66.34 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 121.612 -0.68 . . . . 0.0 111.78 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.18 -50.23 61.76 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.045 1.338 . . . . 0.0 108.853 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.85 -48.68 75.78 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.679 0.752 . . . . 0.0 111.815 176.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 54.8 t -53.98 -54.48 20.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.382 -177.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -63.79 -24.99 67.98 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 177.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -64.08 -43.66 94.73 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.852 0.751 . . . . 0.0 110.244 171.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -60.05 -37.07 78.75 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.619 1.099 . . . . 0.0 110.418 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 22.0 t -71.05 -8.85 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 123.626 0.77 . . . . 0.0 111.61 178.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -117.57 -14.53 10.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.741 1.216 . . . . 0.0 113.376 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -97.86 -5.37 57.54 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 125.793 1.663 . . . . 0.0 112.716 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -68.32 170.95 7.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 122.205 1.002 . . . . 0.0 110.352 165.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -127.49 174.43 9.03 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 126.927 2.091 . . . . 0.0 107.357 172.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.9 m -149.0 16.97 0.96 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.674 1.125 . . . . 0.0 112.722 -171.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 C--O 1.252 1.222 0 C-N-CA 125.732 1.613 . . . . 0.0 108.918 -171.243 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.838 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 42.9 t-80 44.45 96.04 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 128.581 2.752 . . . . 0.0 116.031 174.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -153.99 177.64 10.83 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 123.594 0.758 . . . . 0.0 111.325 171.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -134.24 93.6 3.1 Favored 'General case' 0 C--N 1.341 0.218 0 C-N-CA 126.387 1.875 . . . . 0.0 106.353 173.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 12.0 m-30 52.68 -168.76 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.565 1.546 . . . . 0.0 111.3 -168.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -138.66 150.73 46.53 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 129.313 3.045 . . . . 0.0 107.972 177.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -51.07 -40.95 59.53 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.978 0.911 . . . . 0.0 110.188 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -53.19 -59.47 4.52 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.459 1.503 . . . . 0.0 112.52 174.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -63.46 -26.16 68.6 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.608 1.563 . . . . 0.0 111.407 -175.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 93.1 mt -78.55 -40.62 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 C-N-CA 125.184 1.394 . . . . 0.0 109.742 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.7 -40.66 89.03 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 124.679 1.133 . . . . 0.0 112.431 -175.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.8 t -66.29 -49.37 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.3 mp -54.05 -49.6 68.64 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.202 0.91 . . . . 0.0 110.68 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.6 -38.01 86.04 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.1 0.56 . . . . 0.0 111.248 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.88 -32.58 73.82 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 111.81 -0.516 . . . . 0.0 111.81 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.0 mt -64.94 -23.32 67.19 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 120.468 -1.607 . . . . 0.0 111.671 176.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.457 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -79.98 -17.59 52.51 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.358 -0.839 . . . . 0.0 112.96 171.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.529 HD11 ' HE2' ' A' ' 106' ' ' LYS . 2.9 mp -134.52 97.73 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 125.797 1.639 . . . . 0.0 107.428 -172.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.92 54.96 1.25 Allowed Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.02 0.928 . . . . 0.0 110.605 175.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -56.05 -39.57 90.39 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 123.262 2.641 . . . . 0.0 111.246 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -67.34 -34.4 77.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.803 1.241 . . . . 0.0 112.527 -175.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 34.9 t90 -63.68 -54.33 37.22 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 173.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 tt -50.96 -48.4 61.01 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.158 0.583 . . . . 0.0 110.748 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -59.32 -47.42 85.48 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.904 0.882 . . . . 0.0 111.306 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -58.58 -40.21 82.51 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 120.779 1.627 . . . . 0.0 112.346 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -67.01 -45.02 78.85 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.991 0.9 . . . . 0.0 109.205 -177.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.592 HD11 HD22 ' A' ' 50' ' ' LEU . 96.1 mt -71.8 -32.32 44.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 O-C-N 121.422 -0.799 . . . . 0.0 109.52 -178.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.83 -4.17 33.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.88 0.872 . . . . 0.0 112.581 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.0 -16.24 26.79 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.134 0.879 . . . . 0.0 111.673 160.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 68.83 30.26 4.81 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 127.829 2.452 . . . . 0.0 109.287 -170.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -94.96 -89.15 0.24 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 119.023 -0.513 . . . . 0.0 109.66 178.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.723 HD23 ' HB3' ' A' ' 134' ' ' LEU 0.314 13.0 tp 40.9 97.28 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 129.592 3.157 . . . . 0.0 113.921 175.41 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.9 t -96.14 143.51 12.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 120.096 1.316 . . . . 0.0 109.003 -177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -119.65 137.35 53.94 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 128.139 2.576 . . . . 0.0 107.831 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.15 174.77 32.56 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 176.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.6 mm -116.99 146.2 21.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 172.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.5 t -49.91 -77.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 126.299 1.84 . . . . 0.0 110.755 176.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.6 mttt 57.47 165.81 0.07 OUTLIER Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 125.833 1.653 . . . . 0.0 111.77 -165.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -75.46 -32.85 4.57 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 CA-C-N 120.332 1.154 . . . . 0.0 112.777 -176.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 47.2 t -80.11 67.55 5.96 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.061 1.345 . . . . 0.0 109.043 -177.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -157.2 -167.19 2.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.033 1.733 . . . . 0.0 107.29 159.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.2 m -109.85 105.13 14.21 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 120.238 1.381 . . . . 0.0 107.622 174.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -138.08 159.21 69.25 Favored Pre-proline 0 C--O 1.237 0.446 0 CA-C-N 118.995 0.816 . . . . 0.0 112.709 -171.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -72.86 164.38 35.73 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.467 2.778 . . . . 0.0 111.263 173.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.52 137.68 58.31 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.581 169.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.2 31.42 11.9 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-O 119.392 -0.671 . . . . 0.0 113.725 164.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 13.9 m -135.74 22.72 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-N 118.549 1.175 . . . . 0.0 109.988 171.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -63.27 -9.59 12.26 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 116.928 2.196 . . . . 0.0 116.928 -150.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -147.52 26.61 1.04 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 128.703 2.801 . . . . 0.0 111.324 172.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -78.49 153.93 30.95 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.064 0.946 . . . . 0.0 109.254 176.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.2 m -76.17 151.73 36.85 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 124.499 1.12 . . . . 0.0 108.684 163.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -133.85 145.56 49.8 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 124.129 0.972 . . . . 0.0 110.375 167.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 18.6 mt -115.75 137.77 51.76 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.406 1.883 . . . . 0.0 106.213 175.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 p -149.66 167.8 2.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 104.425 -2.435 . . . . 0.0 104.425 -179.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -109.75 153.59 24.12 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 120.213 -1.555 . . . . 0.0 108.326 167.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.52 3.02 12.22 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -100.33 -47.85 4.78 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 118.866 0.757 . . . . 0.0 109.977 159.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -76.58 24.91 0.14 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.138 1.775 . . . . 0.0 112.453 -174.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -56.09 -28.87 59.44 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.555 1.542 . . . . 0.0 113.683 -164.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -128.0 11.71 6.59 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 127.139 2.176 . . . . 0.0 111.174 174.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -88.18 -56.92 1.97 Allowed Glycine 0 CA--C 1.53 0.98 0 C-N-CA 125.369 1.461 . . . . 0.0 111.105 176.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 75.0 m -127.97 161.4 29.22 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.102 1.361 . . . . 0.0 108.016 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.8 tt -156.98 154.85 5.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 O-C-N 120.382 -1.449 . . . . 0.0 107.671 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 64.5 mt -135.02 150.42 29.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 169.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -124.24 158.86 31.49 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 126.977 2.111 . . . . 0.0 108.917 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -162.72 162.74 26.93 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.974 0.909 . . . . 0.0 110.1 171.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.5 131.09 10.63 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 170.171 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.78 150.38 24.61 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 123.957 0.785 . . . . 0.0 109.554 171.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -117.04 -3.45 11.57 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.256 1.822 . . . . 0.0 111.253 174.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 135.96 -37.19 1.93 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 124.879 1.228 . . . . 0.0 112.258 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.418 ' O ' ' HG ' ' A' ' 110' ' ' LEU . 0.5 OUTLIER -131.13 -59.54 0.98 Allowed 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 125.951 1.7 . . . . 0.0 107.14 166.79 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.4 m -73.16 143.07 47.39 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 119.604 -1.935 . . . . 0.0 110.559 -175.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 71.3 t -133.35 116.06 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 -175.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.8 mp -84.36 94.71 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.467 HG21 HD13 ' A' ' 36' ' ' ILE . 4.4 mt -71.24 127.94 33.8 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 171.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.9 mttt -129.01 108.34 10.32 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -129.37 168.47 16.23 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 121.133 -0.979 . . . . 0.0 109.938 -171.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.5 t -154.63 169.62 23.44 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.524 1.129 . . . . 0.0 108.778 -176.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.6 p -99.32 -14.02 19.39 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.661 0.784 . . . . 0.0 111.86 162.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -134.71 126.93 30.02 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.337 1.055 . . . . 0.0 111.556 -176.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 57.4 ttt-85 -56.59 -30.33 63.07 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 126.681 1.992 . . . . 0.0 112.579 -173.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.92 50.28 1.09 Allowed 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 124.767 1.227 . . . . 0.0 109.889 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.1 p -135.74 156.69 48.43 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.245 1.018 . . . . 0.0 108.511 164.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.33 149.17 46.38 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.247 -0.908 . . . . 0.0 111.15 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -83.89 154.54 23.37 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.983 1.313 . . . . 0.0 110.97 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -71.44 171.29 11.55 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 125.876 1.671 . . . . 0.0 111.112 171.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -114.92 117.26 30.15 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.479 1.512 . . . . 0.0 108.565 167.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.529 ' HE2' HD11 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -134.61 115.62 14.06 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 104.114 -2.55 . . . . 0.0 104.114 156.033 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.09 122.39 39.94 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 -172.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.403 HD11 ' HD2' ' A' ' 106' ' ' LYS . 35.6 mt -138.46 145.55 41.0 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.567 1.147 . . . . 0.0 108.674 -168.276 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 20.7 p -77.18 151.63 35.18 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.313 0.506 . . . . 0.0 110.73 175.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 89' ' ' GLN . 12.3 mt -51.0 -42.08 60.11 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 122.237 1.017 . . . . 0.0 110.807 175.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -35.89 70.49 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 125.091 1.357 . . . . 0.0 111.547 -176.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -68.03 0.37 Allowed 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 126.575 1.95 . . . . 0.0 109.652 174.538 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.61 -38.02 71.48 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.657 1.183 . . . . 0.0 111.279 -173.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -60.32 -34.14 73.38 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.956 0.502 . . . . 0.0 112.155 176.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -69.27 -58.94 3.38 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 120.787 -1.195 . . . . 0.0 108.069 173.909 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -45.87 -57.25 4.49 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.97 2.108 . . . . 0.0 110.537 -175.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -120.49 12.81 11.66 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.041 1.336 . . . . 0.0 112.298 -163.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -147.84 28.44 0.94 Allowed 'General case' 0 C--N 1.342 0.268 0 CA-C-N 120.08 1.309 . . . . 0.0 114.19 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 8.4 pm0 -68.82 -60.14 2.59 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 120.758 -1.214 . . . . 0.0 111.915 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 11.0 t -99.6 163.63 12.42 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 125.362 1.465 . . . . 0.0 109.88 -164.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 53.2 mtt-85 -80.2 -38.29 31.48 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -167.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 8.1 t -57.45 -38.63 74.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.708 0.686 . . . . 0.0 109.654 174.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -62.94 -25.31 68.28 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.684 -0.635 . . . . 0.0 112.368 176.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -71.66 -12.86 61.55 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 117.511 -1.233 . . . . 0.0 111.885 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -71.19 -73.07 0.19 Allowed 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 115.993 -1.956 . . . . 0.0 106.353 162.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -47.71 -55.14 10.16 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 120.243 1.383 . . . . 0.0 112.437 -166.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 78.3 t -54.45 -50.14 60.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 123.59 0.756 . . . . 0.0 110.391 -175.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.71 -34.03 73.33 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 176.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -64.14 -31.62 72.88 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 125.816 1.646 . . . . 0.0 108.835 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.436 ' HA ' HD13 ' A' ' 45' ' ' ILE . 22.0 m-30 -68.39 -41.42 80.56 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.348 1.459 . . . . 0.0 110.957 171.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.67 -35.14 74.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-N 119.296 0.953 . . . . 0.0 109.288 172.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -80.56 10.09 5.22 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.913 -1.117 . . . . 0.0 112.712 172.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -129.72 -5.15 4.56 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 125.954 1.74 . . . . 0.0 112.181 -172.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.723 ' HB3' HD23 ' A' ' 50' ' ' LEU . 4.0 pp -84.38 176.42 8.7 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 118.15 0.975 . . . . 0.0 110.377 167.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -138.2 163.37 31.88 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 128.7 2.8 . . . . 0.0 105.536 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.42 -5.79 15.1 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.244 1.021 . . . . 0.0 110.71 178.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 . . . . . 0 C--O 1.254 1.311 0 C-N-CA 130.169 3.387 . . . . 0.0 105.955 -177.329 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.511 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 37.3 m80 -65.99 135.67 55.01 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 158.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.52 101.79 4.91 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 105.496 -2.038 . . . . 0.0 105.496 -162.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -58.37 121.49 10.95 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -112.18 172.09 7.12 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.774 1.23 . . . . 0.0 107.793 174.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.88 152.69 49.08 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.492 1.117 . . . . 0.0 110.124 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -48.44 -41.38 29.18 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.496 1.118 . . . . 0.0 110.193 173.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -50.31 -63.58 1.08 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.406 2.282 . . . . 0.0 110.487 174.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -70.34 -32.9 70.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.835 2.054 . . . . 0.0 111.354 -172.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 88.2 mt -71.93 -33.94 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 124.613 1.165 . . . . 0.0 108.818 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.36 -46.71 63.74 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 125.157 1.361 . . . . 0.0 111.06 -174.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 65.0 t -67.84 -46.62 81.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 123.276 0.63 . . . . 0.0 109.433 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.7 mp -58.78 -51.91 67.95 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.563 0.745 . . . . 0.0 111.503 -179.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.18 86.7 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.739 -0.648 . . . . 0.0 111.198 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.61 -28.6 72.07 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 118.79 0.723 . . . . 0.0 111.956 176.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mp -65.38 -24.93 67.36 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.35 -1.676 . . . . 0.0 112.44 176.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.42 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -78.57 -22.42 47.16 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 118.813 -0.613 . . . . 0.0 112.611 171.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.42 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.9 mp -130.1 92.12 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.519 1.528 . . . . 0.0 107.017 -172.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.16 63.78 1.08 Allowed Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 124.61 1.164 . . . . 0.0 111.594 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -59.31 -35.36 97.06 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.576 2.184 . . . . 0.0 111.165 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -68.86 -49.84 54.94 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.95 -175.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 59.5 t90 -52.22 -50.73 61.39 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 118.826 0.739 . . . . 0.0 109.796 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.1 tt -53.68 -59.27 4.83 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -62.86 -32.66 73.94 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 117.86 -1.067 . . . . 0.0 112.372 -175.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -63.85 -48.51 76.46 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 120.228 1.376 . . . . 0.0 108.858 176.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -65.85 -34.35 77.94 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 118.384 -0.817 . . . . 0.0 111.883 -177.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.517 HG21 ' CD1' ' A' ' 130' ' ' TYR . 45.1 mm -61.77 -49.72 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 119.428 1.013 . . . . 0.0 109.37 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.73 -3.08 4.27 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.083 0.953 . . . . 0.0 113.324 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.84 -7.07 14.21 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.645 1.978 . . . . 0.0 112.378 172.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.9 t30 44.61 38.67 2.83 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.171 2.188 . . . . 0.0 111.203 -167.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.37 -5.07 19.29 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.491 1.517 . . . . 0.0 111.438 -175.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.62 138.61 36.44 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 92.9 t -118.0 150.47 20.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 126.316 1.846 . . . . 0.0 106.784 175.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -124.82 142.83 51.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.258 3.023 . . . . 0.0 105.616 174.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -167.24 -178.95 39.88 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 27.8 mm -119.1 137.55 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 125.76 1.624 . . . . 0.0 106.83 -176.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.512 HG13 HG11 ' A' ' 61' ' ' VAL . 23.8 t -43.99 -71.98 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.725 1.21 . . . . 0.0 112.606 175.102 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 47.0 mttt 55.06 165.04 0.05 OUTLIER Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.708 1.603 . . . . 0.0 113.03 -164.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -78.84 -22.22 9.06 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 121.008 1.138 . . . . 0.0 111.009 175.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.9 m -77.29 19.56 0.33 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.189 1.796 . . . . 0.0 113.743 -172.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -132.8 177.89 7.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.598 1.559 . . . . 0.0 109.124 176.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.1 m -91.33 112.08 23.84 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.849 1.26 . . . . 0.0 107.902 173.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.512 HG11 HG13 ' A' ' 55' ' ' VAL . 5.7 m -144.47 162.23 40.37 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 123.665 0.786 . . . . 0.0 110.429 -177.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.25 -172.83 1.11 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.315 2.677 . . . . 0.0 112.211 171.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.04 162.23 28.56 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.297 1.039 . . . . 0.0 111.552 165.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.32 33.64 78.2 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 123.93 0.776 . . . . 0.0 113.514 160.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.9 m -144.14 27.15 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 118.39 1.095 . . . . 0.0 111.606 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.79 -16.35 4.34 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -163.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -149.62 15.4 0.87 Allowed 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 128.352 2.661 . . . . 0.0 110.424 -170.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -74.68 132.08 41.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.6 m -68.03 149.33 49.83 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 166.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -136.71 164.32 28.51 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.388 -0.82 . . . . 0.0 110.689 173.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 16.7 mt -139.23 135.88 34.39 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 126.968 2.107 . . . . 0.0 105.878 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.46 ' HB ' HG13 ' A' ' 81' ' ' ILE . 11.8 p -156.17 158.26 3.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -174.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.412 ' HB3' ' H ' ' A' ' 76' ' ' ASP . . . -84.97 154.31 22.23 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.107 -0.996 . . . . 0.0 108.391 168.165 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.49 -16.01 62.86 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.452 -0.785 . . . . 0.0 112.9 175.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -104.03 -39.19 6.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.667 173.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.412 ' H ' ' HB3' ' A' ' 73' ' ' ALA . 1.7 m-20 -82.15 28.79 0.43 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.634 1.174 . . . . 0.0 110.548 -167.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -49.71 -53.66 23.38 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 126.491 1.916 . . . . 0.0 110.534 -169.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -92.51 7.97 40.85 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.045 1.338 . . . . 0.0 113.045 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.2 -68.54 1.02 Allowed Glycine 0 CA--C 1.529 0.919 0 C-N-CA 126.263 1.887 . . . . 0.0 111.432 -176.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.7 m -134.8 143.09 46.88 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.814 1.307 . . . . 0.0 108.987 173.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.46 HG13 ' HB ' ' A' ' 72' ' ' VAL . 7.6 tt -143.44 157.89 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 171.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.2 mt -141.8 137.91 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 176.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -118.09 156.35 28.8 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 124.646 1.178 . . . . 0.0 108.64 176.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -161.02 158.47 27.94 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 120.997 -1.064 . . . . 0.0 110.593 174.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.53 110.16 4.67 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 166.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.24 124.71 32.19 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -151.87 150.79 30.48 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.307 2.243 . . . . 0.0 110.769 -177.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 46.42 53.4 9.66 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.872 1.225 . . . . 0.0 113.815 171.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 53.9 mm-40 57.73 12.11 1.54 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.498 1.919 . . . . 0.0 115.069 -172.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.5 m -128.08 170.23 13.17 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 128.443 2.697 . . . . 0.0 109.119 -168.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.6 p -156.05 109.59 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.689 0 O-C-N 121.003 -1.061 . . . . 0.0 112.616 174.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.665 HD12 ' H ' ' A' ' 92' ' ' ILE . 1.6 mp -79.03 95.38 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 173.075 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 19.2 mt -76.34 128.16 37.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 165.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -118.02 110.75 18.05 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 126.366 1.866 . . . . 0.0 106.405 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.413 ' CD2' HG12 ' A' ' 36' ' ' ILE . 34.7 p90 -126.78 164.96 20.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.146 0.884 . . . . 0.0 112.913 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.6 t -148.75 172.03 15.26 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.958 1.703 . . . . 0.0 108.615 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.6 p -114.93 -1.41 13.13 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.729 1.612 . . . . 0.0 111.953 169.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -143.21 143.28 31.69 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 160.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.0 mtm180 -60.44 -10.87 5.46 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -101.84 1.27 36.88 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.8 p -113.24 156.36 23.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.132 0.967 . . . . 0.0 112.612 -174.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -64.68 132.69 50.39 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 125.847 1.659 . . . . 0.0 109.926 -168.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.4 mt -78.23 140.58 38.9 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -173.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -66.9 -174.33 0.32 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.676 1.19 . . . . 0.0 110.793 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.32 101.83 4.63 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.381 1.072 . . . . 0.0 108.996 178.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -121.29 113.24 19.65 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 103.81 -2.663 . . . . 0.0 103.81 174.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -126.58 106.1 9.18 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 116.319 -1.8 . . . . 0.0 108.031 -166.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 26.7 mt -128.2 154.7 45.52 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 120.71 1.595 . . . . 0.0 109.143 -158.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 22.1 p -73.79 147.21 43.62 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 121.258 1.845 . . . . 0.0 111.44 176.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.6 mt -46.7 -48.89 20.13 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 122.919 1.343 . . . . 0.0 109.77 167.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.24 -15.69 62.46 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.01 0.924 . . . . 0.0 112.281 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -75.83 -56.47 4.64 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 171.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -55.14 -37.61 67.17 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.827 1.194 . . . . 0.0 111.834 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -56.83 -47.72 79.67 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.848 -0.533 . . . . 0.0 110.293 173.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -20.37 63.37 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.164 -0.922 . . . . 0.0 112.564 -176.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -83.01 -57.47 3.27 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.532 0.733 . . . . 0.0 110.952 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -116.28 0.94 13.0 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.391 -0.818 . . . . 0.0 113.064 -163.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.434 ' HA ' HE21 ' A' ' 123' ' ' GLN . 1.6 t80 -138.18 26.9 2.64 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -174.024 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.82 -26.96 40.33 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 174.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 66.2 p -80.09 -165.54 0.86 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.187 0.903 . . . . 0.0 110.972 -168.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 24.7 ttm-85 -114.53 -33.3 5.61 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.486 1.114 . . . . 0.0 111.779 172.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.3 p -62.11 -48.09 81.72 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 126.311 1.845 . . . . 0.0 110.874 174.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.434 HE21 ' HA ' ' A' ' 118' ' ' TYR . 2.7 pm0 -58.03 -25.79 61.6 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -172.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -65.44 -4.43 5.71 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.018 1.327 . . . . 0.0 112.774 175.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -80.08 -83.51 0.1 Allowed 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 105.255 -2.128 . . . . 0.0 105.255 154.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -55.01 -56.46 19.46 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 124.168 0.987 . . . . 0.0 113.533 -160.234 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.17 -21.77 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.131 0.972 . . . . 0.0 111.483 -175.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.62 -39.42 14.08 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.243 1.817 . . . . 0.0 109.924 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -59.55 -40.05 86.01 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 126.987 2.115 . . . . 0.0 110.667 174.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.517 ' CD1' HG21 ' A' ' 45' ' ' ILE . 17.8 m-30 -60.54 -33.08 72.14 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 125.201 1.4 . . . . 0.0 110.783 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 24.2 t -68.58 -13.9 17.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 O-C-N 121.583 -0.698 . . . . 0.0 110.772 175.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -116.08 17.64 15.74 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.286 1.434 . . . . 0.0 111.111 172.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -122.54 -10.61 5.91 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 126.214 1.864 . . . . 0.0 111.788 178.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.31 165.74 24.48 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.412 1.085 . . . . 0.0 108.928 157.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -110.81 162.49 14.74 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 127.426 2.29 . . . . 0.0 107.03 172.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.4 m -132.35 17.67 4.45 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.931 0.492 . . . . 0.0 110.376 176.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 . . . . . 0 C--O 1.25 1.122 0 C-N-CA 128.74 2.816 . . . . 0.0 108.15 -170.347 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.498 0 N-CA-C 109.13 -1.588 . . . . 0.0 109.13 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -58.08 -33.03 68.64 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -171.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.3 mtp 60.24 -167.34 0.18 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.362 0.665 . . . . 0.0 110.836 176.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -133.72 171.06 14.66 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 125.497 1.519 . . . . 0.0 108.619 164.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -102.07 173.13 6.52 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 124.941 1.296 . . . . 0.0 108.387 172.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 p -135.51 150.92 49.91 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 125.134 1.373 . . . . 0.0 108.585 177.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -57.35 -38.73 74.59 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.348 0.659 . . . . 0.0 110.819 -174.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -48.96 -61.28 2.14 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.465 2.306 . . . . 0.0 111.889 172.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 -66.74 -40.05 88.18 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.989 1.716 . . . . 0.0 109.456 -172.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.415 HG21 ' HB2' ' A' ' 86' ' ' ALA . 67.3 mt -61.89 -35.49 68.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 173.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.77 -51.05 59.31 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-O 118.187 -1.34 . . . . 0.0 111.232 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 76.3 t -58.3 -50.23 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 118.134 0.967 . . . . 0.0 109.18 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.4 mp -55.71 -49.82 71.99 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.259 1.024 . . . . 0.0 112.008 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.19 -42.78 93.25 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.919 -0.562 . . . . 0.0 111.32 -177.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.11 -25.24 74.54 Favored Glycine 0 C--N 1.337 0.629 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.095 176.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 tp -66.53 -24.15 66.34 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.307 -1.702 . . . . 0.0 111.74 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.425 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -77.92 -22.82 49.06 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 170.282 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.425 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.8 mp -136.59 101.34 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.543 1.537 . . . . 0.0 106.927 -170.249 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m 64.49 59.2 1.54 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.73 1.212 . . . . 0.0 112.904 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.82 -43.21 12.94 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.33 2.687 . . . . 0.0 112.165 176.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -53.74 -55.28 27.72 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.467 1.03 . . . . 0.0 110.164 -177.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 63.0 t90 -53.33 -42.17 66.46 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.61 1.164 . . . . 0.0 110.714 176.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.59 -53.6 32.67 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 -174.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -58.15 -44.22 87.74 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 123.857 0.863 . . . . 0.0 110.69 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -55.8 -52.35 64.31 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.939 0.896 . . . . 0.0 109.919 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -71.37 -24.39 62.07 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.498 -0.763 . . . . 0.0 111.482 -174.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.46 HG21 ' HD1' ' A' ' 130' ' ' TYR . 24.5 mm -72.18 -38.75 63.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 120.095 1.316 . . . . 0.0 110.579 167.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.09 -6.52 9.17 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.511 1.051 . . . . 0.0 112.756 -178.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.07 10.26 8.14 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.235 1.414 . . . . 0.0 112.267 167.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 50.67 27.44 2.98 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 128.78 2.832 . . . . 0.0 112.521 -178.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -82.77 -8.19 59.6 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 127.045 2.138 . . . . 0.0 112.823 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.8 tp -76.5 147.43 37.81 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.537 1.062 . . . . 0.0 110.225 -175.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.9 t -123.89 159.36 29.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 125.614 1.566 . . . . 0.0 107.782 170.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -129.65 144.54 51.33 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.669 2.787 . . . . 0.0 107.56 173.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -161.5 173.97 37.97 Favored Glycine 0 C--N 1.335 0.522 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 174.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 23.6 mm -106.3 147.77 11.42 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 168.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.631 HG13 HG11 ' A' ' 61' ' ' VAL . 26.7 t -50.72 -77.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 126.103 1.761 . . . . 0.0 112.346 173.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 38.3 mtmt 57.43 165.43 0.07 OUTLIER Pre-proline 0 CA--C 1.541 0.622 0 C-N-CA 126.477 1.911 . . . . 0.0 114.439 -170.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -78.83 64.62 8.76 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 123.078 2.518 . . . . 0.0 109.471 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.1 m -140.29 -17.02 0.92 Allowed 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.205 1.802 . . . . 0.0 112.728 -167.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -146.36 161.5 40.22 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 119.479 1.036 . . . . 0.0 108.985 -168.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 84.9 m -70.93 117.43 12.42 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 119.832 1.196 . . . . 0.0 107.969 173.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.631 HG11 HG13 ' A' ' 55' ' ' VAL . 30.4 m -139.96 159.37 64.76 Favored Pre-proline 0 C--O 1.236 0.352 0 C-N-CA 124.79 1.236 . . . . 0.0 109.161 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.491 ' HG3' HD21 ' A' ' 103' ' ' LEU . 83.9 Cg_endo -72.13 -178.44 3.23 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 121.72 1.614 . . . . 0.0 109.882 169.455 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.09 163.34 28.3 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.355 169.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.79 16.83 69.33 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-O 118.201 -1.333 . . . . 0.0 114.067 166.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.2 m -141.35 19.06 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 CA-C-N 119.115 1.458 . . . . 0.0 113.427 -171.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -57.22 -12.72 2.49 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 127.101 2.16 . . . . 0.0 116.245 -167.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -142.99 14.78 1.9 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.489 1.516 . . . . 0.0 111.813 175.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -70.07 148.1 49.2 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.181 -0.949 . . . . 0.0 108.993 176.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.3 m -72.89 157.79 36.76 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 124.14 0.976 . . . . 0.0 109.779 163.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -136.21 162.17 33.72 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.645 1.178 . . . . 0.0 110.146 163.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 10.1 mt -133.98 136.44 44.13 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 171.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.43 ' HB ' HG13 ' A' ' 81' ' ' ILE . 14.5 p -154.19 -177.99 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 104.9 -2.259 . . . . 0.0 104.9 -179.12 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -132.38 158.44 41.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 120.527 -1.358 . . . . 0.0 110.412 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.83 -17.26 62.75 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 125.653 1.581 . . . . 0.0 114.65 -161.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -117.41 -19.37 9.54 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.332 0.653 . . . . 0.0 111.404 175.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -88.82 38.35 0.88 Allowed 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.818 -1.176 . . . . 0.0 109.995 -178.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -50.98 -52.34 43.65 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.189 -0.944 . . . . 0.0 112.894 -167.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -95.86 2.68 53.83 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.946 0.499 . . . . 0.0 111.456 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.43 -66.66 1.96 Allowed Glycine 0 CA--C 1.527 0.833 0 C-N-CA 125.323 1.439 . . . . 0.0 112.602 -169.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.2 m -144.55 154.1 42.52 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.801 1.24 . . . . 0.0 107.707 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.43 HG13 ' HB ' ' A' ' 72' ' ' VAL . 6.6 tt -153.12 148.91 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-N 119.916 1.234 . . . . 0.0 108.161 174.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.484 HG23 ' HB3' ' A' ' 95' ' ' TYR . 24.0 mt -136.78 149.98 26.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 120.601 -1.312 . . . . 0.0 108.704 172.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -125.07 162.64 24.13 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 126.49 1.916 . . . . 0.0 109.369 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -162.16 160.36 27.08 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.103 -0.998 . . . . 0.0 111.777 175.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -142.88 111.34 6.21 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.907 0.883 . . . . 0.0 109.009 161.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HB2' HG21 ' A' ' 28' ' ' ILE . . . -81.86 102.74 11.04 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 173.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -96.2 90.49 5.51 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 126.389 1.876 . . . . 0.0 106.385 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.91 -137.4 43.93 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.71 5.22 0.13 Allowed 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 116.473 -1.727 . . . . 0.0 115.187 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.0 157.21 44.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 121.657 2.026 . . . . 0.0 110.61 -175.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.4 p -137.12 118.65 18.44 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 O-C-N 120.908 -1.12 . . . . 0.0 113.552 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 13.5 mm -78.5 94.05 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 172.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.421 ' CD1' HD23 ' A' ' 108' ' ' LEU . 27.1 mt -67.68 125.5 25.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 164.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -121.69 95.36 4.64 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 176.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.484 ' HB3' HG23 ' A' ' 82' ' ' ILE . 51.3 p90 -110.11 163.71 13.33 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.563 -1.336 . . . . 0.0 111.653 -177.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -147.23 166.73 26.14 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 170.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.3 p -98.24 -12.09 21.98 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.355 1.462 . . . . 0.0 111.108 171.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -140.13 132.88 29.02 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.924 0.89 . . . . 0.0 108.714 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -55.38 -25.67 36.76 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.04 1.336 . . . . 0.0 112.208 177.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -83.14 -5.29 59.06 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 118.293 2.701 . . . . 0.0 118.293 -178.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.6 p -116.71 161.53 19.1 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.488 1.04 . . . . 0.0 113.774 -169.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.1 tmtt? -64.76 153.08 40.91 Favored 'General case' 0 C--N 1.346 0.419 0 C-N-CA 123.249 0.62 . . . . 0.0 109.71 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.491 HD21 ' HG3' ' A' ' 62' ' ' PRO . 1.4 mm? -88.01 139.58 30.37 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.211 0.529 . . . . 0.0 109.694 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -61.45 174.32 0.76 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.961 0.904 . . . . 0.0 109.713 164.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -132.4 124.47 28.74 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 174.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -127.87 123.13 34.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 162.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.08 127.85 43.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 114.894 -2.479 . . . . 0.0 106.31 172.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.421 HD23 ' CD1' ' A' ' 93' ' ' ILE . 4.0 mm? -124.69 137.45 54.35 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 122.813 2.551 . . . . 0.0 108.479 179.136 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.9 p -64.6 148.43 50.87 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.213 172.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.5 mt -49.62 -42.21 44.34 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 121.35 0.595 . . . . 0.0 109.939 165.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.6 t -62.63 -45.77 91.32 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.459 -177.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -52.26 -61.02 2.54 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 118.551 0.614 . . . . 0.0 110.428 175.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.79 -32.62 72.92 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.714 0.265 . . . . 0.0 111.714 -171.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -66.12 -40.8 90.97 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.546 -0.721 . . . . 0.0 110.052 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -49.53 40.72 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 117.636 -1.173 . . . . 0.0 110.752 -177.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.16 -57.16 12.88 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.211 1.804 . . . . 0.0 108.367 177.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -118.55 16.49 13.73 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -159.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.509 ' CE1' ' HA ' ' A' ' 124' ' ' LYS . 1.5 t80 -147.21 26.59 1.07 Allowed 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -179.148 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . 0.272 5.0 pm0 -79.4 -52.96 7.39 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.891 -1.131 . . . . 0.0 113.793 -178.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.0 p -85.13 159.46 20.15 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.72 1.6 . . . . 0.0 111.638 -172.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -63.27 -45.05 93.3 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 116.774 -1.584 . . . . 0.0 113.932 176.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.7 t -61.49 -39.73 92.0 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 120.152 1.342 . . . . 0.0 108.815 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -56.18 -39.21 72.03 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.509 ' HA ' ' CE1' ' A' ' 118' ' ' TYR . 7.0 mtpm? -58.54 -37.28 75.35 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 118.361 -0.828 . . . . 0.0 112.88 178.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -60.92 2.15 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.32 -52.79 33.75 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.253 1.421 . . . . 0.0 111.249 -177.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 91.1 t -55.67 -48.97 77.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 124.167 0.987 . . . . 0.0 111.194 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -67.12 -31.88 72.64 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.484 0.714 . . . . 0.0 111.663 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.31 -41.76 97.53 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.758 1.623 . . . . 0.0 109.913 175.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.46 ' HD1' HG21 ' A' ' 45' ' ' ILE . 40.5 m-85 -61.01 -38.44 86.09 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 122.86 0.464 . . . . 0.0 112.102 177.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.3 t -64.07 -41.39 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.695 0.68 . . . . 0.0 109.793 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.37 -13.16 61.77 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -102.2 11.5 57.07 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.086 1.327 . . . . 0.0 113.541 -171.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.5 pp -117.22 173.17 6.83 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.108 0.963 . . . . 0.0 110.201 174.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -125.78 167.87 14.59 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 125.231 1.412 . . . . 0.0 108.174 -171.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.91 -6.12 6.18 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 122.306 1.05 . . . . 0.0 113.06 -175.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.061 1 C-N-CA 131.808 4.043 . . . . 0.0 104.983 -174.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.818 0 N-CA-C 111.511 -0.635 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.97 -14.53 4.42 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -170.298 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.51 91.07 2.0 Allowed 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.707 1.594 . . . . 0.0 110.485 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? 59.46 -179.02 0.09 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.067 1.747 . . . . 0.0 111.552 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 59.3 -175.06 0.1 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.926 1.691 . . . . 0.0 109.82 -166.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.31 149.51 42.2 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 165.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -62.39 -35.38 79.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.69 -163.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -43.27 92.87 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.315 0.646 . . . . 0.0 109.907 -178.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -61.32 -36.48 80.23 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 123.257 0.623 . . . . 0.0 109.75 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.5 mt -69.2 -45.4 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -59.7 -36.58 90.23 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.257 -0.746 . . . . 0.0 113.468 -175.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.75 -48.7 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 117.732 0.766 . . . . 0.0 109.501 174.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.89 -44.21 96.7 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 118.719 0.691 . . . . 0.0 110.279 -178.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.62 -43.92 72.67 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.763 0.825 . . . . 0.0 109.775 175.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.99 -35.3 78.5 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.7 mp -62.62 -18.19 61.76 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.274 2.037 . . . . 0.0 112.271 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.422 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -86.23 -17.38 34.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.633 1.573 . . . . 0.0 114.072 171.433 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.422 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.9 mp -135.91 96.21 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 126.883 2.073 . . . . 0.0 106.902 -177.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 58.99 73.59 0.68 Allowed Pre-proline 0 CA--C 1.543 0.712 0 C-N-CA 127.59 2.356 . . . . 0.0 112.388 -178.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -60.34 -46.14 19.46 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.724 2.949 . . . . 0.0 111.916 172.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.33 -27.78 69.28 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.257 0.623 . . . . 0.0 112.042 -174.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -65.03 -65.13 0.71 Allowed 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.286 -0.884 . . . . 0.0 109.024 172.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 tt -52.16 -47.54 65.4 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.0 0.92 . . . . 0.0 110.724 -174.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -59.9 -46.94 87.74 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.65 0.78 . . . . 0.0 110.391 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -61.51 -41.7 97.7 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 119.092 0.86 . . . . 0.0 111.501 173.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -61.03 -49.07 78.88 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.788 0.722 . . . . 0.0 109.171 -176.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.5 mm -61.52 -34.35 61.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 123.938 0.895 . . . . 0.0 110.478 177.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.11 -9.01 19.28 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.933 -1.105 . . . . 0.0 112.931 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -123.46 10.7 9.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.305 1.042 . . . . 0.0 112.42 167.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 52.12 34.49 14.33 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.065 1.746 . . . . 0.0 111.938 -175.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -87.64 -0.64 57.16 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 126.941 2.097 . . . . 0.0 114.638 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 tp -90.69 134.51 34.36 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.371 1.068 . . . . 0.0 109.306 -171.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 53.8 t -118.63 153.53 20.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 126.062 1.745 . . . . 0.0 108.053 174.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -135.26 148.19 49.49 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 127.724 2.41 . . . . 0.0 107.451 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -163.38 173.4 39.51 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 170.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 25.4 mm -95.9 148.1 5.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 161.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.474 HG13 HG21 ' A' ' 61' ' ' VAL . 21.5 t -44.59 -59.19 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 C-N-CA 126.752 2.021 . . . . 0.0 113.647 178.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 mttt 58.77 165.41 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 126.348 1.859 . . . . 0.0 113.522 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -73.76 -25.29 14.73 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 121.837 1.691 . . . . 0.0 111.749 174.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.41 63.77 0.98 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.093 1.757 . . . . 0.0 110.399 -170.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -158.09 -169.23 2.73 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.482 2.313 . . . . 0.0 106.752 169.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 20.5 m -118.97 110.46 17.15 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 120.271 1.396 . . . . 0.0 108.725 172.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.474 HG21 HG13 ' A' ' 55' ' ' VAL . 31.6 m -135.44 163.09 53.32 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 124.89 1.276 . . . . 0.0 112.138 -175.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -75.61 172.86 15.5 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.111 3.207 . . . . 0.0 112.266 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.74 135.39 40.33 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.766 0.826 . . . . 0.0 111.038 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.77 45.13 6.14 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 125.326 1.441 . . . . 0.0 113.163 168.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.7 m -138.84 38.61 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 125.874 1.67 . . . . 0.0 109.392 173.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -65.47 -15.96 63.17 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -148.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -148.27 17.14 1.06 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 127.572 2.349 . . . . 0.0 111.344 175.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.514 ' CG ' ' HB2' ' A' ' 85' ' ' LYS . 3.4 m-85 -61.6 152.66 29.97 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 122.017 0.913 . . . . 0.0 109.358 177.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m -75.01 153.97 38.24 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 126.32 1.848 . . . . 0.0 108.706 165.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 33.9 p90 -137.36 163.62 30.58 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.39 1.076 . . . . 0.0 110.69 167.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.4 mt -141.83 133.05 26.35 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 127.422 2.289 . . . . 0.0 106.726 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.415 ' HB ' HG13 ' A' ' 81' ' ' ILE . 8.8 p -159.05 159.63 2.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.349 1.06 . . . . 0.0 108.672 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.403 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -86.93 146.85 26.0 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 119.095 0.861 . . . . 0.0 109.905 177.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.28 -10.69 11.71 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 126.676 1.991 . . . . 0.0 114.024 176.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -136.36 -6.95 2.0 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 125.678 1.591 . . . . 0.0 113.395 -169.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.403 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 33.5 t70 -130.14 37.61 3.88 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 125.931 1.692 . . . . 0.0 107.512 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.18 -39.3 28.85 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.332 0.653 . . . . 0.0 111.531 -173.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -90.1 -7.15 54.48 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.594 1.157 . . . . 0.0 112.574 -174.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.62 -65.86 1.39 Allowed Glycine 0 C--N 1.334 0.461 0 C-N-CA 124.426 1.012 . . . . 0.0 111.895 -167.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.99 128.04 33.57 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 -171.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.415 HG13 ' HB ' ' A' ' 72' ' ' VAL . 4.0 tt -137.58 149.36 25.45 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 176.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.473 HG23 ' HB3' ' A' ' 95' ' ' TYR . 45.4 mt -133.64 138.11 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 172.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -111.06 152.24 27.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 126.298 1.839 . . . . 0.0 106.828 172.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -154.11 163.43 40.11 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 121.171 -0.955 . . . . 0.0 108.821 171.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.514 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -146.94 109.81 4.68 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 173.426 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -77.06 82.36 3.57 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.417 1.087 . . . . 0.0 108.702 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -74.14 179.53 4.39 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.232 2.213 . . . . 0.0 109.32 172.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.84 117.48 6.68 Favored Glycine 0 CA--C 1.531 1.042 0 O-C-N 120.533 -1.354 . . . . 0.0 112.127 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 53.68 11.45 0.31 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.582 2.353 . . . . 0.0 114.267 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.3 m -143.78 159.33 42.7 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 120.288 1.404 . . . . 0.0 109.151 -166.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.0 t -133.82 116.73 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 167.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.45 ' N ' HD12 ' A' ' 92' ' ' ILE . 2.5 mp -84.36 102.6 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 168.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.45 134.39 27.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 175.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -134.18 97.98 4.0 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.755 1.622 . . . . 0.0 108.465 -175.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.473 ' HB3' HG23 ' A' ' 82' ' ' ILE . 40.9 p90 -122.57 168.49 12.1 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.612 -1.305 . . . . 0.0 110.554 -172.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.9 t -153.1 167.24 29.9 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.509 1.124 . . . . 0.0 109.045 -173.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.5 p -88.77 -15.25 35.14 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.501 0.72 . . . . 0.0 112.422 166.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -150.53 147.03 26.98 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.541 0.736 . . . . 0.0 110.683 -170.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.33 11.2 0.09 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.366 1.866 . . . . 0.0 113.546 176.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 5.8 p-10 -136.44 10.13 3.19 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 117.219 2.304 . . . . 0.0 117.219 -177.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -116.33 158.74 22.95 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.152 0.501 . . . . 0.0 110.509 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.15 131.02 42.94 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 -175.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.457 ' H ' HD22 ' A' ' 103' ' ' LEU . 1.8 mm? -64.3 146.32 54.58 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.294 0.569 . . . . 0.0 110.065 -177.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -59.69 172.1 0.77 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.168 0.987 . . . . 0.0 109.936 163.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -130.23 108.24 9.88 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.188 0.995 . . . . 0.0 108.445 168.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -116.96 85.09 2.26 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 104.17 -2.53 . . . . 0.0 104.17 172.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -79.73 137.77 37.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 171.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.6 mt -143.9 147.79 34.5 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.86 149.77 39.44 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 118.432 0.56 . . . . 0.0 110.554 171.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.43 -38.07 71.07 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.658 0.783 . . . . 0.0 110.528 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.3 t -55.37 -42.59 74.14 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.794 177.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -56.59 19.49 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 123.495 0.718 . . . . 0.0 110.189 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.0 mt -55.0 -39.97 69.63 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 122.771 0.429 . . . . 0.0 111.206 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -69.95 -37.97 75.99 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.795 0.438 . . . . 0.0 110.915 -178.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -29.29 64.23 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.565 1.146 . . . . 0.0 111.156 177.125 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -88.83 -42.86 11.63 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 118.045 -0.978 . . . . 0.0 112.174 -169.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -133.14 14.89 4.21 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.895 0.771 . . . . 0.0 112.754 -176.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -135.83 26.95 3.32 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.637 -1.289 . . . . 0.0 112.892 177.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -93.2 -21.52 19.59 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 126.774 2.03 . . . . 0.0 113.28 -174.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.9 p -87.61 -167.74 1.99 Allowed 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 118.912 0.778 . . . . 0.0 110.324 -175.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 15.5 mmp_? -103.38 -43.31 5.46 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.72 0.808 . . . . 0.0 110.169 161.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.15 -22.65 67.02 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -175.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -65.08 -24.89 67.58 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 120.355 1.434 . . . . 0.0 110.981 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -65.9 -7.45 16.64 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 121.458 -0.776 . . . . 0.0 111.938 174.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.91 -75.86 0.24 Allowed 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 157.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -55.17 -55.6 29.38 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 113.736 1.014 . . . . 0.0 113.736 -166.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 57.8 t -58.83 -54.08 38.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 124.569 1.148 . . . . 0.0 109.754 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.27 -26.1 67.54 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -74.25 -42.56 59.46 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 125.036 1.335 . . . . 0.0 110.393 176.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -57.25 -41.7 80.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.252 0.621 . . . . 0.0 110.205 172.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 25.7 t -70.88 -30.12 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 O-C-N 121.175 -0.953 . . . . 0.0 111.126 177.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -77.54 -15.56 59.19 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.762 0.825 . . . . 0.0 112.596 175.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -105.92 7.2 41.22 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.919 1.723 . . . . 0.0 112.376 -172.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.91 146.69 27.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.563 1.182 . . . . 0.0 110.054 -172.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 12.7 mtt-85 -111.54 155.45 23.27 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 126.98 2.112 . . . . 0.0 109.427 -173.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.3 m -131.51 23.56 4.74 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 122.145 0.974 . . . . 0.0 110.744 -176.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 . . . . . 0 C--O 1.251 1.16 0 C-N-CA 128.696 2.799 . . . . 0.0 112.243 161.161 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.802 0 N-CA-C 110.36 -1.096 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -86.77 -19.08 29.6 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.992 1.717 . . . . 0.0 112.658 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.6 mmm -67.08 131.9 46.77 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 118.389 0.541 . . . . 0.0 109.611 -176.02 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.1 tttt 62.42 -171.34 0.16 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.597 1.959 . . . . 0.0 112.489 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -60.9 167.64 2.76 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 166.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.8 p -135.6 166.97 21.99 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 177.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -57.44 -36.79 71.83 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.844 0.458 . . . . 0.0 110.618 -176.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -49.5 74.77 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.92 1.288 . . . . 0.0 110.858 178.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.56 -39.77 81.2 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.204 1.002 . . . . 0.0 109.69 -175.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 85.9 mt -72.17 -36.49 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 C-N-CA 124.856 1.262 . . . . 0.0 109.809 -176.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -57.01 -33.72 64.53 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 123.653 0.644 . . . . 0.0 112.813 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.06 -55.8 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 118.146 0.973 . . . . 0.0 109.193 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.92 -42.22 75.75 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.98 0.912 . . . . 0.0 111.772 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.45 -51.05 69.88 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.35 1.86 . . . . 0.0 110.799 173.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.52 -25.65 75.3 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 123.264 0.459 . . . . 0.0 112.678 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 74.2 mt -67.49 -20.29 65.44 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 119.575 1.688 . . . . 0.0 112.412 176.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -81.48 -17.39 48.82 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.637 -0.664 . . . . 0.0 112.702 169.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.9 mm -142.95 101.1 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 N-CA-C 106.519 -1.659 . . . . 0.0 106.519 -158.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.2 m 55.8 54.47 9.07 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 123.295 0.638 . . . . 0.0 112.599 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.64 -40.64 44.92 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.121 2.548 . . . . 0.0 111.028 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -65.43 -47.78 75.04 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.774 -0.579 . . . . 0.0 110.29 -170.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -48.23 -45.88 34.75 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.61 1.964 . . . . 0.0 110.396 170.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.493 HD12 ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -67.16 -46.29 74.47 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -166.229 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -62.91 -37.73 88.15 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 117.05 -1.452 . . . . 0.0 111.552 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -59.22 -48.43 81.65 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 120.231 1.378 . . . . 0.0 108.989 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -64.9 -40.93 95.86 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 118.433 -0.794 . . . . 0.0 111.001 -172.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.9 mm -63.72 -44.81 98.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 119.284 0.947 . . . . 0.0 110.556 173.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.94 -11.25 26.64 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -116.51 7.6 13.77 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.297 1.439 . . . . 0.0 112.008 174.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 46.12 34.38 2.07 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.295 2.638 . . . . 0.0 112.969 -175.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -82.66 -13.54 56.26 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.7 1.6 . . . . 0.0 113.863 -177.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.6 tp -93.71 123.62 37.17 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.584 -0.698 . . . . 0.0 110.228 -156.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 79.0 t -104.36 140.71 21.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 124.541 1.136 . . . . 0.0 108.176 173.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -108.36 151.35 26.13 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 129.141 2.976 . . . . 0.0 106.841 169.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -165.4 173.9 41.17 Favored Glycine 0 N--CA 1.451 -0.306 0 O-C-N 121.517 -0.74 . . . . 0.0 111.658 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -107.8 143.37 18.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 163.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.726 HG13 HG11 ' A' ' 61' ' ' VAL . 27.2 t -48.5 -60.82 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 125.73 1.612 . . . . 0.0 113.703 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.2 mttt 60.63 165.92 0.09 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.866 1.666 . . . . 0.0 113.262 -170.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -72.7 -7.43 20.78 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.14 1.894 . . . . 0.0 112.514 171.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 m -70.04 -34.85 73.77 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.584 0.754 . . . . 0.0 112.437 -177.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -107.17 167.59 9.8 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 119.005 0.82 . . . . 0.0 112.163 -160.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.9 m -89.17 103.82 16.41 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.071 0.948 . . . . 0.0 109.555 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.726 HG11 HG13 ' A' ' 55' ' ' VAL . 28.9 m -140.45 156.58 69.47 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 123.602 0.761 . . . . 0.0 111.899 -164.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -71.84 179.28 4.93 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.649 2.233 . . . . 0.0 110.149 172.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.9 162.76 27.84 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.741 0.816 . . . . 0.0 110.228 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.8 13.56 82.99 Favored Glycine 0 CA--C 1.529 0.918 0 CA-C-O 118.907 -0.941 . . . . 0.0 113.376 171.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.659 ' O ' HG11 ' A' ' 55' ' ' VAL . 12.7 m -146.38 75.03 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 C-N-CA 125.685 1.594 . . . . 0.0 108.956 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.53 -15.29 33.28 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 119.964 -1.71 . . . . 0.0 113.183 173.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -150.81 5.72 0.51 Allowed 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 125.528 1.531 . . . . 0.0 110.933 -161.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -69.42 144.33 53.37 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 167.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.5 m -71.01 163.26 27.94 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.309 163.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -142.46 166.95 23.26 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.994 0.918 . . . . 0.0 111.118 169.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 20.4 mt -142.15 134.48 27.83 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 127.338 2.255 . . . . 0.0 107.55 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.6 p -160.95 157.64 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 125.992 1.717 . . . . 0.0 106.648 -171.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.465 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -77.0 157.39 31.22 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.022 -1.049 . . . . 0.0 109.022 167.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.07 -11.35 60.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 118.149 -0.929 . . . . 0.0 112.78 169.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -136.49 21.74 3.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.623 1.569 . . . . 0.0 110.896 -171.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.465 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 33.4 m-20 -140.71 43.98 1.83 Allowed 'General case' 0 N--CA 1.471 0.624 0 O-C-N 120.321 -1.487 . . . . 0.0 107.785 172.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.89 -48.33 80.96 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.1 -1.0 . . . . 0.0 110.654 -172.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -76.05 -3.67 37.1 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.48 -98.21 0.8 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.162 0.887 . . . . 0.0 112.166 -173.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 19.4 m -104.79 151.06 24.23 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.487 -1.008 . . . . 0.0 109.405 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.8 tt -153.83 154.41 7.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-N 119.256 0.934 . . . . 0.0 109.339 165.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 53.6 mt -130.25 127.05 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 171.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -102.67 155.79 18.07 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.03 1.332 . . . . 0.0 107.919 168.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 7.0 p90 -161.15 153.89 20.77 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 120.913 -1.117 . . . . 0.0 109.757 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.0 tttt -142.38 119.96 11.76 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 172.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.48 140.66 32.19 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.036 0.835 . . . . 0.0 109.077 169.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -134.72 84.09 2.08 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.212 1.805 . . . . 0.0 108.075 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 73.63 -49.06 1.63 Allowed Glycine 0 CA--C 1.529 0.956 0 C-N-CA 125.969 1.747 . . . . 0.0 113.237 175.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.405 ' O ' ' HG ' ' A' ' 110' ' ' LEU . 48.9 mt-30 -142.06 -43.51 0.34 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.96 2.104 . . . . 0.0 110.308 166.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 4.4 m -78.75 126.21 30.41 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 120.226 -1.546 . . . . 0.0 109.719 -165.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 23.8 t -105.65 113.39 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.1 mp -83.32 95.19 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 169.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.5 mt -76.55 117.51 21.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 172.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -113.08 83.7 1.87 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.467 1.907 . . . . 0.0 107.865 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -102.3 166.91 10.31 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 120.396 -1.44 . . . . 0.0 110.837 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 13.7 t -136.06 177.88 7.49 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 169.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.8 p -128.31 -3.07 5.6 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 126.228 1.811 . . . . 0.0 110.683 171.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -147.24 142.46 27.24 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 157.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 39.1 mmm-85 -57.74 -34.26 69.33 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.504 0.721 . . . . 0.0 112.834 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.76 13.6 0.62 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -179.049 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.0 p -132.92 158.89 41.47 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 119.482 1.037 . . . . 0.0 110.401 171.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.54 174.24 1.04 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-O 122.253 1.025 . . . . 0.0 110.968 171.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -83.66 149.57 26.43 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.653 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -177.39 0.39 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.224 1.81 . . . . 0.0 108.35 156.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -154.14 94.6 1.75 Allowed 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.006 -1.059 . . . . 0.0 111.558 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.7 tptt -101.43 119.98 39.59 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 173.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -114.44 123.42 49.39 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.922 1.289 . . . . 0.0 109.014 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 24.7 mt -142.84 141.42 31.59 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.322 1.049 . . . . 0.0 109.299 -168.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 p -78.78 148.71 32.85 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 120.411 1.459 . . . . 0.0 111.62 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 89' ' ' GLN . 9.7 mt -56.44 -30.82 63.32 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 120.855 -1.153 . . . . 0.0 111.937 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -46.92 77.46 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 124.257 1.023 . . . . 0.0 110.981 177.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -55.07 -59.56 4.59 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.575 -1.202 . . . . 0.0 108.99 168.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -48.09 -45.21 32.4 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.423 1.01 . . . . 0.0 111.538 -176.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -69.96 -30.94 68.42 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.47 0.708 . . . . 0.0 111.834 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -65.89 0.63 Allowed 'General case' 0 C--N 1.323 -0.548 0 O-C-N 120.758 -1.214 . . . . 0.0 107.873 169.507 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -44.54 -51.61 8.75 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.535 2.334 . . . . 0.0 110.311 -172.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -125.18 13.25 8.32 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.132 0.973 . . . . 0.0 111.932 -166.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -136.44 15.52 3.19 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 119.985 1.266 . . . . 0.0 112.375 172.611 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . 0.261 0.2 OUTLIER -62.11 -45.12 94.87 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 178.725 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.35 -176.11 2.13 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 119.934 1.243 . . . . 0.0 110.579 -164.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -25.02 39.16 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 119.197 -2.189 . . . . 0.0 111.29 170.009 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.35 -22.13 28.6 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 125.139 1.376 . . . . 0.0 109.563 -166.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.433 ' HB2' ' CD1' ' A' ' 118' ' ' TYR . 0.2 OUTLIER -54.94 -33.53 62.35 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.994 0.918 . . . . 0.0 110.644 173.343 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.84 -3.42 2.43 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.968 1.707 . . . . 0.0 113.109 178.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.06 -2.41 2.56 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 128.35 2.66 . . . . 0.0 111.903 -175.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -112.08 -70.18 0.82 Allowed 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 124.974 1.309 . . . . 0.0 108.174 174.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.6 t -49.33 -58.26 1.43 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 C-N-CA 124.915 1.286 . . . . 0.0 108.901 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -18.46 58.17 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -179.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -85.08 -43.23 14.08 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 125.84 1.656 . . . . 0.0 111.275 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -62.93 -34.49 77.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.25 0.62 . . . . 0.0 110.298 177.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 17.2 t -66.04 -16.73 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.051 -1.031 . . . . 0.0 111.167 173.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -106.58 2.48 26.1 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.408 1.483 . . . . 0.0 111.902 176.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -114.56 -6.68 19.33 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.474 1.035 . . . . 0.0 112.692 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -80.05 169.9 17.2 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.541 1.17 . . . . 0.0 110.229 173.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -124.5 162.56 23.72 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.635 1.974 . . . . 0.0 106.898 175.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.4 m -132.75 11.18 4.36 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.581 0.628 . . . . 0.0 111.807 -175.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 C--O 1.252 1.207 0 C-N-CA 124.208 1.003 . . . . 0.0 108.404 -157.321 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.749 0 CA-C-O 119.895 -0.392 . . . . 0.0 113.024 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -140.29 144.86 36.63 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.577 1.151 . . . . 0.0 108.05 171.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -148.05 176.57 10.09 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 124.583 1.153 . . . . 0.0 110.686 -172.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.6 ptmt -143.26 163.98 31.47 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 126.292 1.837 . . . . 0.0 106.699 173.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 62.25 164.6 0.1 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 128.084 2.554 . . . . 0.0 112.421 -173.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.1 p -88.13 159.87 18.02 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 173.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -48.54 -47.8 39.01 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.864 0.866 . . . . 0.0 110.488 173.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -55.08 32.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.867 0.867 . . . . 0.0 110.374 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -58.97 -43.87 91.43 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.734 1.613 . . . . 0.0 110.396 -173.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 85.1 mt -60.89 -45.27 98.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 125.521 1.528 . . . . 0.0 108.592 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -61.74 -35.12 90.76 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 124.206 0.907 . . . . 0.0 112.908 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.405 HG21 HG22 ' A' ' 131' ' ' VAL . 93.4 t -66.23 -51.8 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.107 0 CA-C-N 118.161 0.981 . . . . 0.0 108.634 177.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.35 -40.52 97.51 Favored 'General case' 0 CA--C 1.522 -0.097 0 O-C-N 121.947 -0.471 . . . . 0.0 111.661 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.17 -34.56 76.65 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.469 -0.3 . . . . 0.0 110.576 175.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.22 -28.65 57.8 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.16 -27.08 69.12 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.059 1.429 . . . . 0.0 111.247 170.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.432 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -74.13 -21.67 59.77 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.118 -0.988 . . . . 0.0 111.939 174.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.432 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.7 mp -131.07 91.92 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 125.558 1.543 . . . . 0.0 108.755 -171.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.18 67.5 0.92 Allowed Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.426 1.49 . . . . 0.0 110.041 -178.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -64.25 -33.19 60.72 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.716 2.277 . . . . 0.0 111.528 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -65.16 -48.02 74.99 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 117.56 -1.209 . . . . 0.0 110.32 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -48.7 -61.49 2.01 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.651 0.78 . . . . 0.0 109.912 168.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.419 HD22 HD11 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -45.45 -58.27 3.48 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.137 1.775 . . . . 0.0 109.94 -177.413 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -63.07 -44.58 95.4 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.787 1.235 . . . . 0.0 111.651 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -62.06 -32.88 73.45 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 119.372 0.987 . . . . 0.0 111.08 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -65.59 -50.34 65.46 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 41.8 mm -60.18 -36.59 69.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 118.518 0.599 . . . . 0.0 111.203 177.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.34 -12.42 21.0 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 118.675 0.67 . . . . 0.0 112.693 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.62 19.8 7.28 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.204 1.802 . . . . 0.0 111.761 172.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 51.71 23.77 2.13 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 127.747 2.419 . . . . 0.0 113.164 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -78.68 -26.45 45.0 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.785 1.234 . . . . 0.0 113.624 -165.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.419 HD11 HD22 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -76.81 145.11 38.67 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.473 1.509 . . . . 0.0 109.69 -157.608 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 22.0 t -124.31 158.39 31.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 126.453 1.901 . . . . 0.0 108.612 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -124.14 143.11 50.67 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 127.055 2.142 . . . . 0.0 106.571 165.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -149.15 163.97 29.22 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 110.252 -1.139 . . . . 0.0 110.252 169.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 20.1 mm -93.29 144.21 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 105.281 -2.118 . . . . 0.0 105.281 157.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 68' ' ' TYR . 28.1 t -45.18 -68.13 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 126.454 1.902 . . . . 0.0 112.394 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.7 mttt 59.76 150.75 0.09 OUTLIER Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 130.342 3.457 . . . . 0.0 113.178 -165.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -77.74 -16.35 14.72 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.172 1.915 . . . . 0.0 113.335 -170.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -69.25 -3.59 14.4 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.35 -0.844 . . . . 0.0 112.84 175.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -115.55 172.59 7.02 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.574 1.55 . . . . 0.0 108.593 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.9 m -108.9 123.94 49.86 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 -168.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.535 HG11 HG13 ' A' ' 55' ' ' VAL . 0.6 OUTLIER -142.64 155.82 63.36 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.025 0.93 . . . . 0.0 111.374 -170.283 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.536 ' HG2' HD21 ' A' ' 103' ' ' LEU . 8.2 Cg_endo -65.93 172.99 7.63 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.563 2.842 . . . . 0.0 111.171 164.264 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.15 139.81 44.76 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 121.323 -0.861 . . . . 0.0 111.861 -178.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.54 54.45 3.72 Favored Glycine 0 CA--C 1.488 -1.638 0 C-N-CA 126.201 1.858 . . . . 0.0 113.848 172.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.805 HG23 ' HB2' ' A' ' 68' ' ' TYR . 1.6 p 176.35 71.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 -169.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.9 -16.12 13.93 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.599 1.159 . . . . 0.0 111.27 176.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -145.2 12.71 1.39 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.406 2.282 . . . . 0.0 110.321 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.805 ' HB2' HG23 ' A' ' 65' ' ' VAL . 4.1 m-85 -62.21 147.42 47.89 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 168.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.4 m -71.9 159.94 33.4 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 163.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -140.55 155.84 46.48 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.4 1.08 . . . . 0.0 109.982 165.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -117.9 133.76 55.61 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 167.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.6 p -149.83 164.94 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.884 1.674 . . . . 0.0 106.783 169.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.432 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -98.31 149.66 22.38 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 119.982 1.264 . . . . 0.0 108.381 171.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.82 -18.69 64.37 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -172.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -136.04 26.43 3.27 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.535 2.334 . . . . 0.0 109.024 -175.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.432 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 25.7 t70 -128.88 39.22 3.83 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 128.138 2.575 . . . . 0.0 105.417 159.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -67.41 -50.3 60.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 127.159 2.184 . . . . 0.0 110.778 -161.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -96.84 39.88 1.16 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.539 1.536 . . . . 0.0 107.664 167.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -116.59 -126.08 3.82 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 126.247 1.879 . . . . 0.0 110.146 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.53 136.18 33.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 117.427 0.614 . . . . 0.0 109.976 -172.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.1 tt -140.19 151.09 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-O 121.585 0.707 . . . . 0.0 109.782 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.528 HG23 ' HB3' ' A' ' 95' ' ' TYR . 7.8 mt -134.9 108.72 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.038 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -77.08 152.98 34.79 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.155 0.889 . . . . 0.0 109.552 167.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.0 p90 -152.86 164.91 36.98 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.313 -1.492 . . . . 0.0 109.825 166.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -148.55 138.04 21.99 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 158.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -74.98 151.24 38.83 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 162.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -138.46 13.54 2.77 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.342 1.857 . . . . 0.0 111.444 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 103.5 100.84 2.61 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 108.79 -1.724 . . . . 0.0 108.79 -178.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 49.6 12.92 0.07 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.576 1.95 . . . . 0.0 115.097 -171.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.68 148.37 39.0 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.892 1.277 . . . . 0.0 107.688 -174.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 60.1 t -135.45 114.72 16.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 125.377 1.471 . . . . 0.0 107.743 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.46 HD12 ' H ' ' A' ' 92' ' ' ILE . 3.9 mp -79.38 101.23 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 167.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mt -79.65 113.11 18.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 169.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.437 ' HD2' ' CE2' ' A' ' 68' ' ' TYR . 13.0 mttt -109.76 100.41 9.42 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -178.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.528 ' HB3' HG23 ' A' ' 82' ' ' ILE . 43.6 p90 -124.7 174.18 8.05 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 121.548 -0.72 . . . . 0.0 110.869 -171.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.425 HG23 ' O ' ' A' ' 98' ' ' GLN . 1.5 t -169.42 164.72 10.64 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -173.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -13.38 60.52 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.076 0.95 . . . . 0.0 112.896 166.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.425 ' O ' HG23 ' A' ' 96' ' ' THR . 2.1 tt0 -135.56 -170.6 2.64 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.12 0.968 . . . . 0.0 110.754 -162.197 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.52 -70.38 0.8 Allowed 'General case' 0 CA--C 1.503 -0.839 0 C-N-CA 125.48 1.512 . . . . 0.0 109.798 -173.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -77.23 51.31 0.83 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.644 0.778 . . . . 0.0 112.554 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.1 p -141.81 165.51 27.28 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 119.734 -1.854 . . . . 0.0 111.283 176.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.04 161.55 24.14 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.599 -0.688 . . . . 0.0 110.734 174.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.536 HD21 ' HG2' ' A' ' 62' ' ' PRO . 1.2 mm? -114.42 160.43 19.18 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.877 1.271 . . . . 0.0 109.966 -163.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -73.96 177.16 5.82 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.511 0.724 . . . . 0.0 109.217 162.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.02 51.4 1.31 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.304 1.041 . . . . 0.0 112.043 -171.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.571 ' HE3' HD21 ' A' ' 108' ' ' LEU . 31.3 tptt -65.56 120.14 12.37 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 106.314 -1.735 . . . . 0.0 106.314 173.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -122.18 93.12 3.89 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 119.883 1.22 . . . . 0.0 108.361 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.571 HD21 ' HE3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -95.92 159.75 14.81 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 123.941 0.896 . . . . 0.0 108.722 178.296 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 68.6 p -73.96 155.2 38.89 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.625 167.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 28.3 mt -57.57 -39.12 76.02 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 120.361 -1.462 . . . . 0.0 109.405 166.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 t -63.54 -34.12 77.09 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 124.139 0.976 . . . . 0.0 111.195 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.66 -69.18 0.13 Allowed 'General case' 0 C--N 1.345 0.391 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 168.569 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -53.66 -35.26 60.83 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.255 0.622 . . . . 0.0 112.407 -169.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 7.9 tmtm? -62.28 -58.23 8.49 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 118.082 0.401 . . . . 0.0 110.695 173.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.87 -30.48 70.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.703 -170.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.3 -85.36 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.809 2.444 . . . . 0.0 108.023 170.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -90.03 -16.02 30.62 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -161.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -115.06 45.39 1.63 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.146 0.979 . . . . 0.0 110.156 -167.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.72 -37.48 27.24 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -164.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . 0.314 0.1 OUTLIER -101.17 -164.42 1.11 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.375 1.07 . . . . 0.0 109.968 -173.195 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.92 -22.47 16.3 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.959 1.704 . . . . 0.0 111.971 162.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 35.7 p -80.42 -31.17 37.67 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 117.619 -1.182 . . . . 0.0 110.841 -173.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -61.44 -30.09 70.36 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.397 1.453 . . . . 0.0 110.771 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 12.2 mtpt -52.8 -34.81 55.33 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 118.838 -0.601 . . . . 0.0 109.731 -178.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.47 -26.33 65.16 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.119 -0.943 . . . . 0.0 112.806 -178.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -99.86 -51.61 3.67 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 118.495 0.589 . . . . 0.0 110.065 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.3 t -59.26 -48.44 86.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 O-C-N 121.703 -0.623 . . . . 0.0 110.368 -174.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -61.98 -36.96 83.05 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 121.81 -0.556 . . . . 0.0 111.794 175.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -62.32 -42.8 99.68 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.223 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -58.91 -39.35 81.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.211 1.005 . . . . 0.0 110.306 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.405 HG22 HG21 ' A' ' 30' ' ' VAL . 97.8 t -68.95 -33.08 57.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 O-C-N 121.694 -0.629 . . . . 0.0 111.236 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -86.38 -16.28 37.8 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.128 0.877 . . . . 0.0 111.712 174.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.39 -46.29 6.56 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 125.72 1.629 . . . . 0.0 110.787 -178.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.1 pp -55.29 142.44 31.84 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.45 0.643 . . . . 0.0 109.805 176.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.26 171.68 11.73 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.801 1.641 . . . . 0.0 110.103 172.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.76 -5.48 11.57 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.876 0.87 . . . . 0.0 111.782 171.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 . . . . . 0 C--O 1.24 0.567 0 C-N-CA 130.919 3.688 . . . . 0.0 107.098 175.435 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.049 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -138.74 125.93 21.46 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 175.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 44.37 56.7 4.8 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.04 1.736 . . . . 0.0 112.372 -176.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.81 121.07 6.25 Favored 'General case' 0 C--N 1.338 0.097 0 O-C-N 120.933 -1.104 . . . . 0.0 109.733 177.259 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 65.57 -173.56 0.18 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.938 2.495 . . . . 0.0 110.089 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 p -126.53 149.27 49.48 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.251 1.42 . . . . 0.0 107.666 164.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -66.11 -23.89 66.59 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.602 1.161 . . . . 0.0 111.424 -169.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -56.65 -48.88 76.58 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.284 2.233 . . . . 0.0 109.798 170.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -67.72 -36.02 79.84 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.726 1.61 . . . . 0.0 110.742 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 97.6 mt -69.8 -42.84 80.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 C-N-CA 123.975 0.91 . . . . 0.0 111.037 -172.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -65.06 -29.93 76.65 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 119.062 0.847 . . . . 0.0 112.152 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.6 t -62.65 -56.73 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 171.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.4 mp -56.58 -40.36 75.11 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.706 0.802 . . . . 0.0 112.169 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.54 69.69 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.9 0.773 . . . . 0.0 111.069 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.05 -21.88 79.5 Favored Glycine 0 CA--C 1.533 1.168 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 mp -66.06 -22.45 66.42 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 120.268 -1.725 . . . . 0.0 112.116 170.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.85 -18.43 32.88 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.103 -0.951 . . . . 0.0 113.078 173.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -132.71 94.99 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -176.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 59.33 70.52 1.09 Allowed Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 126.698 1.999 . . . . 0.0 111.741 -174.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -56.94 -45.42 36.35 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 122.206 1.937 . . . . 0.0 110.584 173.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.43 -46.21 80.37 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.63 0.772 . . . . 0.0 112.091 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -57.18 -49.33 76.31 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 119.04 0.836 . . . . 0.0 109.559 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.0 tt -55.15 -58.2 8.65 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.8 mtpt -55.48 -39.97 71.09 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.544 1.138 . . . . 0.0 110.97 -174.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -67.6 -48.33 67.11 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 118.317 0.508 . . . . 0.0 111.019 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -66.26 -29.24 69.44 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.818 -176.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.4 mm -64.61 -45.39 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 119.706 1.139 . . . . 0.0 109.764 169.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.83 -10.06 34.53 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.972 -1.08 . . . . 0.0 112.759 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.86 -4.7 25.83 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.334 1.453 . . . . 0.0 112.991 171.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 46.1 39.8 6.36 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.329 1.452 . . . . 0.0 110.496 -167.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -105.68 -13.44 15.57 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.303 1.441 . . . . 0.0 112.373 -177.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.8 134.52 34.31 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.036 0.934 . . . . 0.0 108.93 -167.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.6 t -117.23 164.79 13.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 125.704 1.602 . . . . 0.0 109.232 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -144.21 110.56 5.51 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 129.698 3.199 . . . . 0.0 103.214 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.51 170.8 24.6 Favored Glycine 0 CA--C 1.518 0.253 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 170.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 42.2 mm -99.96 143.53 13.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -175.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.594 HG13 HG11 ' A' ' 61' ' ' VAL . 24.9 t -51.18 -60.43 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 C-N-CA 124.98 1.312 . . . . 0.0 111.538 174.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.5 mttt 60.14 165.69 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 125.361 1.464 . . . . 0.0 113.909 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -63.92 -25.83 67.02 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.865 1.71 . . . . 0.0 112.743 170.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 30.4 m -86.75 2.7 47.85 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -164.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -125.14 160.78 28.33 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 119.69 1.132 . . . . 0.0 110.548 -170.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.0 m -89.3 114.89 26.33 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.655 0.782 . . . . 0.0 109.101 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.594 HG11 HG13 ' A' ' 55' ' ' VAL . 6.0 m -143.04 165.24 27.16 Favored Pre-proline 0 C--O 1.237 0.436 0 O-C-N 121.369 -0.832 . . . . 0.0 112.428 -170.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.42 ' CG ' HD21 ' A' ' 103' ' ' LEU . 34.6 Cg_endo -66.89 165.0 27.49 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.136 2.557 . . . . 0.0 111.495 168.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.49 137.92 54.81 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 121.835 -0.54 . . . . 0.0 110.562 174.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.0 25.22 11.55 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-O 118.756 -1.024 . . . . 0.0 114.783 161.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.6 m -136.54 29.58 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 124.515 1.126 . . . . 0.0 110.883 -174.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -58.16 -16.27 12.83 Favored 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 117.584 2.439 . . . . 0.0 117.584 -153.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -156.2 32.56 0.33 Allowed 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 127.465 2.306 . . . . 0.0 108.985 172.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -69.4 155.91 39.68 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 167.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.67 153.8 36.94 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 161.058 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -136.81 149.49 47.78 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.724 0.809 . . . . 0.0 109.828 164.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.91 127.17 54.78 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 175.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -145.56 159.6 12.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 171.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.537 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -85.84 159.43 19.71 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 169.044 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.86 -18.78 57.98 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -122.95 7.69 9.29 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.75 1.62 . . . . 0.0 112.539 -173.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.537 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 14.2 t70 -110.38 21.18 16.98 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.0 0.92 . . . . 0.0 111.16 -174.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -49.08 -44.32 41.88 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 128.054 2.542 . . . . 0.0 113.096 -167.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -103.57 -8.81 19.75 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.967 0.907 . . . . 0.0 111.948 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.3 -69.36 1.4 Allowed Glycine 0 C--N 1.334 0.467 0 C-N-CA 125.73 1.633 . . . . 0.0 110.36 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.59 161.83 36.96 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.895 0.847 . . . . 0.0 110.815 -170.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tt -163.18 152.23 3.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 171.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.7 mt -133.36 143.67 38.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 168.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -118.5 149.91 40.5 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.826 1.651 . . . . 0.0 108.194 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -147.35 159.99 43.04 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.047 1.294 . . . . 0.0 111.87 171.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.0 tttm -154.85 110.59 3.14 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.173 0.589 . . . . 0.0 110.692 167.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.42 108.73 2.06 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 127.992 2.517 . . . . 0.0 112.87 172.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -121.45 97.58 5.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.726 1.21 . . . . 0.0 111.345 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 48.92 77.43 0.12 Allowed Glycine 0 CA--C 1.522 0.509 0 C-N-CA 124.317 0.961 . . . . 0.0 113.199 174.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 68.43 -86.56 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.503 1.921 . . . . 0.0 107.906 -155.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.2 m -64.11 131.63 48.08 Favored 'General case' 0 C--N 1.314 -0.962 0 C-N-CA 125.043 1.337 . . . . 0.0 113.769 -157.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 107' ' ' ALA . 2.8 m -101.05 114.6 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 O-C-N 121.089 -1.007 . . . . 0.0 111.424 -179.19 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.504 HD12 ' H ' ' A' ' 92' ' ' ILE . 4.3 mp -72.6 100.59 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 172.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.413 ' CD1' HD23 ' A' ' 108' ' ' LEU . 16.8 mt -81.08 139.76 17.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 167.276 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -129.7 112.53 13.74 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.273 1.429 . . . . 0.0 107.484 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.3 p90 -137.55 167.43 21.68 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 120.854 -1.154 . . . . 0.0 110.533 -168.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -153.48 170.86 19.71 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.681 0.753 . . . . 0.0 109.258 -173.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.88 0.6 13.8 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.257 1.023 . . . . 0.0 110.827 169.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -143.87 153.45 42.35 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 124.108 0.963 . . . . 0.0 111.557 168.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -77.78 1.96 18.58 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 121.421 -0.8 . . . . 0.0 112.409 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.58 1.45 14.27 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.038 1.495 . . . . 0.0 115.038 -174.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.6 p -120.04 173.09 7.29 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.722 0.809 . . . . 0.0 112.544 -165.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.7 tptt -71.26 132.1 44.45 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.597 0.759 . . . . 0.0 109.924 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.443 ' H ' HD22 ' A' ' 103' ' ' LEU . 1.9 mm? -64.18 132.29 49.96 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.243 0.544 . . . . 0.0 109.562 170.373 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -67.1 175.43 2.59 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 125.358 1.463 . . . . 0.0 109.425 164.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -124.48 153.07 42.56 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.895 1.278 . . . . 0.0 110.007 176.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.459 ' CD ' HD21 ' A' ' 108' ' ' LEU . 0.4 OUTLIER -165.3 109.63 0.87 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 127.567 2.347 . . . . 0.0 104.773 168.021 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.414 ' HA ' ' O ' ' A' ' 91' ' ' VAL . . . -97.05 121.5 39.01 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 115.412 -2.232 . . . . 0.0 108.073 -171.033 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.459 HD21 ' CD ' ' A' ' 106' ' ' LYS . 3.4 mm? -119.64 121.97 40.48 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 122.869 2.577 . . . . 0.0 110.782 -171.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.9 p -59.17 143.97 47.3 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.299 0.571 . . . . 0.0 109.946 176.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 29.3 mt -52.31 -31.58 33.69 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.612 -1.305 . . . . 0.0 112.166 171.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.1 t -64.05 -43.36 95.72 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 117.169 -1.396 . . . . 0.0 111.819 174.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -51.88 -65.58 0.53 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-N 119.57 1.077 . . . . 0.0 109.512 173.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -56.9 -34.23 67.7 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.354 0.525 . . . . 0.0 111.647 -169.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 ttmp? -70.71 -40.16 73.0 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 118.689 -0.672 . . . . 0.0 110.53 -177.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -59.15 3.95 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 173.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -47.46 -50.81 22.09 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 124.184 0.928 . . . . 0.0 111.978 -173.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -130.55 14.65 5.47 Favored 'General case' 0 C--O 1.226 -0.182 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -165.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -149.69 22.83 0.9 Allowed 'General case' 0 C--O 1.239 0.54 0 O-C-N 120.521 -1.362 . . . . 0.0 113.157 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -55.51 -29.04 58.13 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.094 1.758 . . . . 0.0 113.846 -176.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.417 HG23 ' H ' ' A' ' 123' ' ' GLN . 9.6 t -135.7 159.9 40.19 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.069 1.348 . . . . 0.0 111.052 -169.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -71.08 -33.02 69.81 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.867 176.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.57 -37.83 88.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 119.686 1.13 . . . . 0.0 109.918 -176.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.417 ' H ' HG23 ' A' ' 120' ' ' THR . 10.3 tt0 -63.27 -19.27 64.42 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.661 1.185 . . . . 0.0 112.955 175.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -55.72 -32.91 63.76 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 117.836 -1.078 . . . . 0.0 111.298 174.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -54.21 -59.19 5.0 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 124.039 0.837 . . . . 0.0 110.469 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.07 -47.04 39.29 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 123.35 0.66 . . . . 0.0 110.455 -168.211 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 58.1 t -56.4 -56.53 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -59.35 -31.09 68.88 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 118.529 -0.748 . . . . 0.0 113.014 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -67.68 -37.57 82.51 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 119.064 0.847 . . . . 0.0 111.187 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -61.64 -42.46 98.93 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.611 0.641 . . . . 0.0 109.595 171.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 15.4 t -63.1 -38.89 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 121.445 -0.784 . . . . 0.0 110.517 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -81.14 -18.87 44.9 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.824 0.85 . . . . 0.0 112.535 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -108.27 -5.59 32.31 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 125.531 1.539 . . . . 0.0 114.103 -177.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.6 pp -78.08 146.09 35.42 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 118.764 1.282 . . . . 0.0 108.953 170.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 2.7 mtp-105 -90.38 165.01 14.1 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 124.149 0.98 . . . . 0.0 108.978 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.0 m -121.69 6.07 9.99 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.696 0.798 . . . . 0.0 111.203 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . 0.331 7.8 pt-20 . . . . . 0 C--O 1.247 0.921 0 C-N-CA 129.47 3.108 . . . . 0.0 113.177 -162.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.974 0 N-CA-C 111.89 -0.484 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -159.58 43.35 0.22 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.553 1.541 . . . . 0.0 109.376 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.7 tpt -147.98 134.52 19.77 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 120.855 -1.153 . . . . 0.0 107.894 173.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . 0.259 0.0 OUTLIER 53.1 -179.39 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.639 2.376 . . . . 0.0 113.667 -174.404 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -59.65 123.74 17.88 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 168.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.3 p -93.57 165.58 12.67 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -56.36 -44.26 79.96 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.968 0.804 . . . . 0.0 110.211 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.36 -50.64 72.32 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.57 0.748 . . . . 0.0 110.03 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -59.01 -48.38 81.8 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.564 1.145 . . . . 0.0 109.708 -175.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.2 mt -65.5 -35.91 76.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -175.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -57.83 -36.6 80.62 Favored Glycine 0 C--N 1.338 0.654 0 CA-C-O 118.967 -0.907 . . . . 0.0 112.712 177.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 75.6 t -70.13 -46.45 72.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 118.176 0.988 . . . . 0.0 109.157 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 113' ' ' LEU . 3.1 mp -60.15 -46.31 90.09 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.398 1.079 . . . . 0.0 111.508 177.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.99 -48.66 64.31 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.676 1.19 . . . . 0.0 110.515 175.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.07 -30.36 77.53 Favored Glycine 0 C--N 1.337 0.623 0 CA-C-O 119.15 -0.806 . . . . 0.0 113.619 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 34' ' ' LEU . 68.3 mt -63.77 -22.59 66.98 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 119.698 1.749 . . . . 0.0 112.408 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.447 ' HB2' ' CE2' ' A' ' 117' ' ' PHE . . . -94.56 -16.39 23.3 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 118.526 -0.75 . . . . 0.0 112.272 174.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -126.59 94.64 2.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.0 65.88 2.22 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 125.417 1.487 . . . . 0.0 111.865 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.38 -44.17 48.65 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.067 2.511 . . . . 0.0 111.891 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -66.9 -38.74 86.81 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.971 0.908 . . . . 0.0 110.251 -173.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 75.7 t90 -55.66 -56.31 21.94 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.7 tt -54.86 -52.3 63.22 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.867 -0.52 . . . . 0.0 110.785 -178.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.7 mttm -56.24 -47.7 77.96 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.655 0.782 . . . . 0.0 111.65 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -66.07 -38.48 88.4 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 118.937 0.79 . . . . 0.0 110.15 -177.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -69.12 -42.04 76.58 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.648 0.658 . . . . 0.0 110.62 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 25.4 mm -57.62 -40.29 74.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 119.203 0.911 . . . . 0.0 110.645 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.86 -20.08 55.02 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -119.96 23.25 11.13 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 120.949 -1.095 . . . . 0.0 112.117 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.4 t30 45.18 35.41 1.7 Allowed 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.967 2.107 . . . . 0.0 110.748 -176.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -79.52 -12.66 59.86 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 121.28 -0.887 . . . . 0.0 109.799 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -107.77 123.55 48.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 119.144 0.884 . . . . 0.0 108.863 -156.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.478 HG12 HG13 ' A' ' 72' ' ' VAL . 3.5 p -111.11 142.98 21.9 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 C-N-CA 124.565 1.146 . . . . 0.0 109.427 -178.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -99.0 137.78 37.04 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 126.065 1.746 . . . . 0.0 106.703 163.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.06 178.64 30.83 Favored Glycine 0 CA--C 1.522 0.494 0 CA-C-N 119.349 0.977 . . . . 0.0 110.944 176.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 18.4 mm -115.07 146.59 19.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 125.557 1.543 . . . . 0.0 107.371 172.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.456 HG13 HG11 ' A' ' 61' ' ' VAL . 32.2 t -54.11 -75.49 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.253 1.273 0 C-N-CA 126.067 1.747 . . . . 0.0 110.935 171.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp 54.33 158.23 0.06 OUTLIER Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 129.291 3.036 . . . . 0.0 112.06 -156.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -70.87 -4.9 15.7 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 122.334 2.023 . . . . 0.0 111.526 167.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.4 m -67.98 3.55 1.52 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.53 1.932 . . . . 0.0 113.409 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -136.32 173.55 11.59 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.271 1.396 . . . . 0.0 110.668 -173.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 m -90.11 104.12 16.73 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.255 1.822 . . . . 0.0 108.118 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.456 HG11 HG13 ' A' ' 55' ' ' VAL . 4.0 m -150.44 154.39 35.66 Favored Pre-proline 0 C--O 1.238 0.488 0 O-C-N 121.894 -0.504 . . . . 0.0 111.625 -168.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.21 166.42 26.96 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.684 2.256 . . . . 0.0 110.954 175.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -76.79 146.93 37.55 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.477 0.711 . . . . 0.0 110.482 -174.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.01 32.53 44.16 Favored Glycine 0 CA--C 1.528 0.858 0 O-C-N 121.693 -0.629 . . . . 0.0 113.976 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.9 m -133.63 26.12 1.15 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-N 118.787 1.294 . . . . 0.0 109.806 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -61.05 -16.16 40.54 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -154.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -143.81 14.88 1.74 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 127.337 2.255 . . . . 0.0 111.516 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -66.27 146.29 54.78 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.52 161.98 29.76 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.159 163.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 21.4 p90 -135.55 172.25 13.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 125.23 1.412 . . . . 0.0 109.604 165.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.9 mt -130.91 135.84 48.04 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 106.181 -1.785 . . . . 0.0 106.181 168.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.478 HG13 HG12 ' A' ' 51' ' ' VAL . 3.7 p -149.19 152.64 11.82 Favored 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-N 120.431 1.469 . . . . 0.0 110.766 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.407 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -78.86 112.39 15.98 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 172.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.16 -9.66 18.14 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 129.565 3.146 . . . . 0.0 114.735 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -106.55 -39.33 5.89 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.478 0.711 . . . . 0.0 109.733 169.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 7.4 t0 -94.55 51.01 1.38 Allowed 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 -171.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -67.82 -2.67 7.63 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -166.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -124.45 14.35 8.86 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.194 1.798 . . . . 0.0 111.459 166.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -80.23 -88.09 0.55 Allowed Glycine 0 N--CA 1.448 -0.531 0 O-C-N 120.835 -1.165 . . . . 0.0 111.194 175.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.3 m -130.69 160.86 33.04 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 123.799 0.84 . . . . 0.0 109.291 -170.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.8 tt -154.25 153.79 7.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 169.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.47 HG23 ' HB3' ' A' ' 95' ' ' TYR . 8.7 mt -139.73 112.21 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 119.017 0.826 . . . . 0.0 109.503 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -86.34 154.7 21.02 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.22 0.918 . . . . 0.0 110.987 177.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.7 p90 -163.06 155.59 18.66 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.995 0.918 . . . . 0.0 109.682 172.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.7 tttt -143.25 113.45 7.27 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 123.976 0.91 . . . . 0.0 108.568 167.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -84.81 95.91 9.13 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -66.01 -2.69 4.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.371 0.669 . . . . 0.0 112.385 179.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 91.62 127.64 4.01 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 107.45 -2.26 . . . . 0.0 107.45 -178.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.41 ' H ' HD12 ' A' ' 110' ' ' LEU . 90.8 mm-40 52.9 -12.82 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.473 1.909 . . . . 0.0 115.364 -162.048 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 59.9 m -144.37 156.81 44.4 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 122.346 2.339 . . . . 0.0 109.604 175.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 107' ' ' ALA . 6.9 p -146.89 106.95 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 C-N-CA 124.892 1.277 . . . . 0.0 111.442 -175.297 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -78.47 108.27 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 176.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 27.0 mt -95.49 126.01 48.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 125.339 1.456 . . . . 0.0 108.258 174.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -123.81 101.73 7.43 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 126.071 1.749 . . . . 0.0 106.709 -173.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.47 ' HB3' HG23 ' A' ' 82' ' ' ILE . 27.6 p90 -116.96 166.49 12.12 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.161 -0.962 . . . . 0.0 111.746 -176.119 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -147.88 169.08 20.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.094 1.358 . . . . 0.0 109.339 173.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.7 p -108.98 -2.67 18.08 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.046 2.539 . . . . 0.0 111.171 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -135.38 131.8 36.78 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 124.407 1.083 . . . . 0.0 108.871 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -23.89 40.48 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -97.78 -0.03 46.03 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 116.354 1.983 . . . . 0.0 116.354 -167.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.7 p -116.48 167.16 11.3 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -165.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -72.5 152.96 41.6 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.486 -0.759 . . . . 0.0 109.408 176.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -87.9 162.75 16.74 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.77 0.828 . . . . 0.0 111.567 -167.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -73.44 -173.85 1.51 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.882 1.673 . . . . 0.0 108.989 166.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.0 93.91 2.56 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.081 0.952 . . . . 0.0 111.053 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.565 ' HE3' HD11 ' A' ' 108' ' ' LEU . 29.9 tptt -103.2 150.3 23.82 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 163.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.4 ' HA ' ' O ' ' A' ' 91' ' ' VAL . . . -140.88 125.82 18.23 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 115.708 -2.091 . . . . 0.0 107.159 175.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.565 HD11 ' HE3' ' A' ' 106' ' ' LYS . 1.1 mm? -121.8 158.63 28.44 Favored 'General case' 0 CA--C 1.499 -1.015 0 CA-C-N 122.114 2.233 . . . . 0.0 108.316 -177.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 68.7 p -74.08 156.56 37.31 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 119.891 1.223 . . . . 0.0 109.365 166.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.41 HD12 ' H ' ' A' ' 89' ' ' GLN . 34.5 mt -59.33 -36.1 75.06 Favored 'General case' 0 C--N 1.34 0.154 0 O-C-N 121.441 -0.787 . . . . 0.0 110.079 167.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.86 -36.44 82.32 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.799 -177.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.31 -59.05 4.64 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 124.062 0.945 . . . . 0.0 109.137 171.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.604 ' HB3' HD23 ' A' ' 31' ' ' LEU . 2.6 mm? -56.14 -40.03 73.17 Favored 'General case' 0 C--N 1.339 0.125 0 C-N-CA 123.09 0.556 . . . . 0.0 112.071 -175.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -63.58 -45.35 90.81 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 121.784 -0.573 . . . . 0.0 110.009 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -35.06 74.45 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.242 -0.409 . . . . 0.0 110.436 -177.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.46 -58.84 4.03 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.373 0.669 . . . . 0.0 109.241 177.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.447 ' CE2' ' HB2' ' A' ' 35' ' ' ALA . 6.6 m-85 -134.26 19.17 3.7 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -161.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.538 ' HB2' HD21 ' A' ' 31' ' ' LEU . 0.5 OUTLIER -141.01 66.34 1.37 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.268 1.395 . . . . 0.0 112.867 171.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -119.32 -25.54 6.07 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 -167.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.2 t -139.66 152.59 46.86 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 120.423 1.465 . . . . 0.0 108.644 -172.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -58.85 -30.51 67.76 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 119.916 -1.74 . . . . 0.0 113.202 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 65.5 m -53.05 -48.3 67.77 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 118.637 -0.697 . . . . 0.0 110.388 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.38 -33.03 64.81 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 117.169 -1.812 . . . . 0.0 107.88 -178.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 124' ' ' LYS . 35.2 mtpt -62.94 -3.39 1.6 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 114.22 1.193 . . . . 0.0 114.22 174.442 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -76.55 -81.89 0.08 Allowed 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 105.35 -2.093 . . . . 0.0 105.35 155.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.64 -49.57 76.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -163.193 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.48 ' HA ' ' CD2' ' A' ' 130' ' ' TYR . 38.3 t -56.86 -38.24 58.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 125.346 1.458 . . . . 0.0 110.722 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.62 -32.88 47.66 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.396 -0.815 . . . . 0.0 110.871 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -69.15 -31.38 70.0 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 120.899 -1.125 . . . . 0.0 111.461 175.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' TYR . . . . . 0.48 ' CD2' ' HA ' ' A' ' 127' ' ' VAL . 14.7 m-85 -63.06 -24.68 68.02 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 120.496 -1.378 . . . . 0.0 111.237 172.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 40.3 t -78.19 -11.99 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 122.942 0.497 . . . . 0.0 110.445 174.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -104.71 -17.01 14.79 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.423 1.089 . . . . 0.0 111.972 172.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -96.91 17.94 58.39 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 125.762 1.648 . . . . 0.0 113.026 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.0 pp -106.45 149.08 27.41 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 122.18 0.99 . . . . 0.0 110.275 177.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.409 ' HB3' HG23 ' A' ' 51' ' ' VAL . 5.1 mtt-85 -75.61 169.33 18.32 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.185 2.194 . . . . 0.0 107.83 163.091 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.22 -3.84 2.42 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.328 1.051 . . . . 0.0 113.014 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 C--O 1.245 0.847 0 C-N-CA 131.162 3.785 . . . . 0.0 107.145 177.196 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.602 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 10.4 m80 -77.16 156.02 31.88 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.562 1.181 . . . . 0.0 110.265 174.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 14.2 ptt? -120.46 170.07 9.73 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.908 1.683 . . . . 0.0 110.042 174.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -137.08 140.52 42.04 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 125.079 1.352 . . . . 0.0 108.286 175.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 49.14 -173.05 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.937 1.695 . . . . 0.0 112.126 -165.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -141.2 144.68 34.9 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 129.223 3.009 . . . . 0.0 106.438 174.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -53.01 -43.57 66.6 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 120.174 1.352 . . . . 0.0 110.531 -174.089 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -45.13 -54.22 7.09 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.065 1.746 . . . . 0.0 110.942 174.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.8 mm-40 -68.35 -36.9 79.93 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.675 1.19 . . . . 0.0 111.496 -177.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.402 HD13 ' HB3' ' A' ' 86' ' ' ALA . 97.9 mt -71.8 -39.92 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.066 0 C-N-CA 123.632 0.773 . . . . 0.0 109.39 -173.347 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.13 -35.55 92.13 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-N 118.828 0.74 . . . . 0.0 112.199 -175.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.6 -45.33 98.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 118.303 1.051 . . . . 0.0 109.534 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.62 -38.47 90.35 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.981 0.912 . . . . 0.0 110.711 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.95 -41.03 83.11 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.707 0.803 . . . . 0.0 111.188 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.71 -33.44 71.35 Favored Glycine 0 CA--C 1.528 0.87 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 176.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.57 -30.25 71.39 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 120.639 -1.507 . . . . 0.0 111.38 172.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.31 64.43 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 117.683 -1.151 . . . . 0.0 112.189 172.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -135.56 96.71 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 C-N-CA 125.375 1.47 . . . . 0.0 107.885 -165.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 60.98 67.41 1.46 Allowed Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.524 1.13 . . . . 0.0 109.762 -177.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -60.29 -33.88 94.18 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.734 2.289 . . . . 0.0 110.866 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -70.37 -39.64 74.48 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.66 -0.65 . . . . 0.0 111.955 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.1 t90 -56.97 -53.23 60.42 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.131 0.878 . . . . 0.0 108.859 174.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -46.4 -57.14 4.93 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.437 1.495 . . . . 0.0 109.329 173.276 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.1 mtpt -61.68 -41.08 97.08 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.464 1.106 . . . . 0.0 112.27 -175.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -67.55 -48.09 67.97 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.46 1.027 . . . . 0.0 109.562 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -42.03 81.05 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.801 0.441 . . . . 0.0 110.2 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.2 mm -60.52 -54.9 28.74 Favored 'Isoleucine or valine' 0 C--N 1.341 0.236 0 C-N-CA 124.438 1.095 . . . . 0.0 110.132 174.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.75 -42.85 65.33 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.352 0.661 . . . . 0.0 110.691 -175.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.23 -8.44 53.61 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 50.34 40.66 23.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.946 1.698 . . . . 0.0 110.979 -165.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -111.64 -5.57 14.48 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.871 0.868 . . . . 0.0 113.337 178.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.0 tp -73.63 128.7 36.21 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 119.172 0.896 . . . . 0.0 109.643 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.8 t -113.54 150.18 15.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 169.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -120.02 149.18 42.58 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 128.067 2.547 . . . . 0.0 106.908 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -163.7 177.21 39.64 Favored Glycine 0 N--CA 1.45 -0.413 0 N-CA-C 111.581 -0.607 . . . . 0.0 111.581 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.6 mm -106.45 149.24 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 125.375 1.47 . . . . 0.0 107.055 168.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.78 HG13 HG11 ' A' ' 61' ' ' VAL . 24.7 t -52.4 -86.02 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-O 116.866 -1.54 . . . . 0.0 110.627 172.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.408 ' N ' HG12 ' A' ' 55' ' ' VAL . 55.3 mmtt 55.44 164.99 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.925 0 CA-C-N 120.408 1.458 . . . . 0.0 112.956 -167.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -84.12 -3.36 10.29 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.36 2.707 . . . . 0.0 114.632 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.5 m -59.36 -24.16 63.16 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.369 1.068 . . . . 0.0 113.409 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.16 165.75 17.68 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 128.982 2.913 . . . . 0.0 108.103 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.4 t -65.64 146.69 54.5 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 121.781 -0.574 . . . . 0.0 109.568 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.78 HG11 HG13 ' A' ' 55' ' ' VAL . 1.9 m -153.55 162.36 26.82 Favored Pre-proline 0 C--O 1.237 0.413 0 C-N-CA 125.73 1.612 . . . . 0.0 108.865 174.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -75.71 167.82 25.59 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.798 2.332 . . . . 0.0 110.423 171.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.68 139.81 51.32 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 123.62 0.768 . . . . 0.0 109.996 171.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.54 39.45 5.01 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 125.797 1.665 . . . . 0.0 112.842 169.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.3 m -152.2 27.79 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 125.454 1.501 . . . . 0.0 111.143 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -65.75 -16.19 63.54 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -151.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -153.07 52.06 0.74 Allowed 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 128.547 2.739 . . . . 0.0 106.542 169.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -89.46 154.89 19.68 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 164.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.63 162.14 28.51 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 164.201 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -141.3 170.76 15.12 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.539 1.136 . . . . 0.0 109.757 166.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 18.7 mt -141.22 138.66 33.46 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 126.461 1.904 . . . . 0.0 107.176 174.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.516 HG21 HH21 ' A' ' 99' ' ' ARG . 10.8 p -162.4 155.82 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 125.636 1.574 . . . . 0.0 107.571 177.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.04 158.18 30.7 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 119.724 1.147 . . . . 0.0 108.97 170.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.26 -21.23 66.11 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 177.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -100.01 -32.01 11.17 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.11 0.964 . . . . 0.0 111.305 176.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.08 13.84 0.19 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.551 2.341 . . . . 0.0 112.076 -178.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -59.5 -12.33 6.13 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.95 1.7 . . . . 0.0 113.793 -171.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.59 -2.83 9.36 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.923 0.889 . . . . 0.0 112.119 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.02 -87.92 1.72 Allowed Glycine 0 CA--C 1.526 0.764 0 C-N-CA 124.405 1.002 . . . . 0.0 112.483 -174.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 m -103.62 166.96 10.1 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.709 1.204 . . . . 0.0 109.298 -174.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.3 tt -166.65 151.24 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 124.64 1.176 . . . . 0.0 107.983 165.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.555 HG23 ' HB3' ' A' ' 95' ' ' TYR . 10.9 mt -134.6 99.19 2.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -78.6 153.04 31.46 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -157.9 158.96 36.04 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.491 -0.755 . . . . 0.0 109.333 167.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.435 ' HA ' ' HE3' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -143.02 106.89 4.66 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 167.805 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.402 ' HB3' HD13 ' A' ' 28' ' ' ILE . . . -82.69 147.61 28.39 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 168.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -147.57 -153.74 0.51 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 126.127 1.771 . . . . 0.0 107.911 -167.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.93 88.89 0.01 OUTLIER Glycine 0 CA--C 1.527 0.795 0 C-N-CA 125.815 1.674 . . . . 0.0 111.432 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 53.88 8.72 0.17 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.554 2.342 . . . . 0.0 115.491 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.6 m -125.35 163.48 22.49 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.554 1.942 . . . . 0.0 108.124 -175.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 7.7 p -151.19 106.37 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -0.99 0 C-N-CA 125.158 1.383 . . . . 0.0 111.865 174.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.457 HD12 ' H ' ' A' ' 92' ' ' ILE . 3.9 mp -74.41 96.65 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 172.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 15.3 mt -77.8 127.56 38.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 105.991 -1.855 . . . . 0.0 105.991 163.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -127.11 97.14 4.83 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 125.389 1.475 . . . . 0.0 107.343 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.555 ' HB3' HG23 ' A' ' 82' ' ' ILE . 47.7 p90 -124.03 167.6 13.97 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.018 -1.051 . . . . 0.0 109.69 -173.483 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . 0.3 9.8 t -131.68 -163.71 1.36 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.83 0.824 . . . . 0.0 109.557 -166.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 p -122.59 -1.63 9.0 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 120.874 -1.141 . . . . 0.0 111.209 152.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -153.48 145.44 23.62 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 124.606 1.163 . . . . 0.0 111.697 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.516 HH21 HG21 ' A' ' 72' ' ' VAL . 11.1 mmt180 -52.13 -33.75 41.35 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 167.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -79.71 -5.22 54.79 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 -173.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -133.11 163.93 28.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -168.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.496 ' HD2' ' H ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -69.45 164.02 24.0 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.553 1.168 . . . . 0.0 111.452 -164.866 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.496 ' H ' ' HD2' ' A' ' 102' ' ' LYS . 1.3 mm? -94.9 138.3 32.83 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.99 -1.005 . . . . 0.0 108.707 -174.142 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 7.8 mptt -60.38 169.18 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.627 1.171 . . . . 0.0 109.86 161.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -127.07 90.62 3.18 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.765 1.226 . . . . 0.0 109.849 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.71 83.66 1.88 Allowed 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 171.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.43 138.65 47.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 117.241 -1.361 . . . . 0.0 107.334 168.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.0 mt -133.79 -177.45 4.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 120.693 1.588 . . . . 0.0 106.795 171.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 62.1 p -101.13 155.73 17.83 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.666 0.746 . . . . 0.0 110.467 172.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 21.7 mt -59.83 -16.67 30.32 Favored 'General case' 0 C--O 1.237 0.435 0 O-C-N 121.641 -0.662 . . . . 0.0 112.238 166.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.16 -50.95 10.18 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 117.561 -1.209 . . . . 0.0 109.5 172.045 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -44.95 -61.27 1.68 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 124.403 1.081 . . . . 0.0 109.517 176.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.4 -36.93 74.31 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.214 0.916 . . . . 0.0 112.052 -168.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -65.2 -45.01 86.54 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.522 -0.736 . . . . 0.0 110.417 173.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.27 -2.01 26.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.868 2.067 . . . . 0.0 113.505 177.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -105.95 -46.57 4.07 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.067 1.747 . . . . 0.0 109.69 179.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -139.16 16.9 2.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.373 1.069 . . . . 0.0 113.248 -166.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -139.68 14.86 2.52 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 120.862 -1.149 . . . . 0.0 113.331 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLN . . . . . 0.44 ' CD ' ' H ' ' A' ' 119' ' ' GLN . 2.2 pm0 -58.2 -64.15 1.02 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 9.6 p -73.37 179.56 3.92 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.914 0.779 . . . . 0.0 111.286 -168.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 36.2 mtt85 -81.51 -55.85 4.41 Favored 'General case' 0 CA--C 1.507 -0.696 0 O-C-N 121.46 -0.775 . . . . 0.0 111.642 170.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 11.5 m -66.13 -26.99 67.7 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.191 -168.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -55.64 -37.77 68.64 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.159 0.584 . . . . 0.0 111.015 173.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.4 mtpt -62.2 -28.43 69.67 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 118.157 -0.925 . . . . 0.0 110.71 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -63.86 -51.76 63.15 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.89 -57.31 9.15 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 123.6 0.76 . . . . 0.0 110.978 178.343 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 65.9 t -51.23 -51.14 24.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -73.78 -24.83 59.89 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.8 0.727 . . . . 0.0 112.555 -176.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -61.04 -48.02 83.67 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.926 0.89 . . . . 0.0 109.274 166.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 7.7 m-30 -61.28 -41.02 96.25 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.875 0.87 . . . . 0.0 109.719 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.0 t -64.17 -22.56 31.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 O-C-N 121.14 -0.975 . . . . 0.0 110.837 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -104.08 -13.94 16.09 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 119.842 1.201 . . . . 0.0 113.075 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.98 -27.17 58.85 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 124.459 1.028 . . . . 0.0 110.686 174.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.5 pp -73.42 147.29 44.37 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 118.3 1.05 . . . . 0.0 110.282 175.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -105.83 167.03 10.06 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.474 1.51 . . . . 0.0 107.785 -177.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.7 m -126.34 3.06 7.02 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.438 1.017 . . . . 0.0 111.431 175.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.149 0 C-N-CA 127.509 2.324 . . . . 0.0 107.181 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.657 0 CA-C-O 119.073 -0.848 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -63.37 98.31 0.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.594 1.558 . . . . 0.0 111.725 -169.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 25.2 ttt -155.68 138.19 15.0 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 120.318 1.417 . . . . 0.0 110.496 174.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? 74.75 101.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 129.209 3.004 . . . . 0.0 108.826 -167.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 56.35 -174.92 0.06 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.765 1.226 . . . . 0.0 109.995 -178.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.0 p -141.52 153.49 44.92 Favored 'General case' 0 N--CA 1.463 0.209 0 O-C-N 120.46 -1.4 . . . . 0.0 111.245 -177.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -61.21 -39.0 88.58 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.494 0.717 . . . . 0.0 110.846 -167.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -49.88 70.68 Favored 'General case' 0 C--N 1.341 0.196 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -177.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 60.9 mm-40 -60.81 -47.44 86.35 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.998 1.319 . . . . 0.0 109.29 -177.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 84.5 mt -61.34 -38.5 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 123.433 0.693 . . . . 0.0 110.242 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.64 -19.67 73.26 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 119.136 -0.813 . . . . 0.0 113.636 -178.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.9 t -70.53 -52.66 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 170.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.83 -36.29 83.44 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 122.297 -0.252 . . . . 0.0 110.755 -176.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.63 -49.67 69.98 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.424 0.69 . . . . 0.0 111.622 171.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.93 -34.3 88.14 Favored Glycine 0 CA--C 1.529 0.935 0 CA-C-O 119.56 -0.578 . . . . 0.0 111.726 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.19 -27.51 68.74 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.412 1.606 . . . . 0.0 112.041 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.36 -14.56 60.08 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.089 -1.007 . . . . 0.0 112.653 172.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.422 HD12 ' CE1' ' A' ' 95' ' ' TYR . 45.2 mm -136.43 89.65 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 124.947 1.299 . . . . 0.0 107.583 -167.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.65 60.49 1.42 Allowed Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.652 1.181 . . . . 0.0 110.376 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -58.28 -33.86 98.07 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.286 2.658 . . . . 0.0 112.511 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.61 -34.71 78.9 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.083 0.553 . . . . 0.0 111.762 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -64.94 -55.92 16.3 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 175.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.2 tt -49.15 -50.3 38.29 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.903 0.481 . . . . 0.0 110.055 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -55.56 -54.23 46.58 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.439 1.096 . . . . 0.0 112.041 177.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -56.82 -42.18 79.14 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.675 0.671 . . . . 0.0 111.689 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -65.02 -53.04 52.3 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.334 1.053 . . . . 0.0 109.992 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 mm -58.61 -40.88 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 C-N-CA 124.555 1.142 . . . . 0.0 109.78 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.17 -8.44 17.12 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.648 0.779 . . . . 0.0 112.802 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -121.36 5.86 10.18 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.013 1.725 . . . . 0.0 111.87 175.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 44.95 33.16 0.95 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.516 1.927 . . . . 0.0 111.825 -168.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -98.96 43.48 1.06 Allowed 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 176.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -134.52 142.46 47.02 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.572 1.078 . . . . 0.0 108.284 172.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.755 HG23 ' HB3' ' A' ' 135' ' ' ARG . 2.8 p -126.53 165.84 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 C-N-CA 126.651 1.98 . . . . 0.0 110.579 175.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -131.62 120.19 22.49 Favored 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 103.232 -2.877 . . . . 0.0 103.232 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -135.46 -178.98 16.11 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mm -122.39 144.54 31.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 C-N-CA 125.631 1.572 . . . . 0.0 107.545 172.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.7 t -45.85 -75.19 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 C-N-CA 128.481 2.713 . . . . 0.0 111.958 174.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.408 ' HB3' ' HD2' ' A' ' 57' ' ' PRO . 19.4 mmtp 57.3 166.61 0.07 OUTLIER Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 119.543 1.065 . . . . 0.0 111.326 -166.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 56' ' ' LYS . 96.1 Cg_endo -79.07 -4.06 13.61 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.29 1.993 . . . . 0.0 112.299 -178.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.7 p -58.31 -78.86 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 128.673 2.789 . . . . 0.0 111.808 -171.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.47 153.38 28.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.31 121.09 16.18 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.051 1.34 . . . . 0.0 109.048 -169.7 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.1 m -135.36 160.92 66.18 Favored Pre-proline 0 C--O 1.24 0.601 0 C-N-CA 123.962 0.905 . . . . 0.0 110.241 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.46 171.37 13.1 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.335 2.023 . . . . 0.0 110.603 170.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.37 151.4 34.88 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.425 171.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.9 47.82 11.02 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 124.653 1.121 . . . . 0.0 111.122 174.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.6 m -151.4 26.28 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 125.796 1.638 . . . . 0.0 110.15 170.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -61.75 -16.9 53.4 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.577 2.066 . . . . 0.0 116.577 -151.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -144.71 14.34 1.55 Allowed 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 128.082 2.553 . . . . 0.0 111.445 -172.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -70.69 149.47 46.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.186 1.395 . . . . 0.0 109.666 -179.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.2 m -73.25 164.28 26.9 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.892 163.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -142.19 158.36 43.83 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.218 1.007 . . . . 0.0 109.947 166.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.71 136.29 54.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.577 1.551 . . . . 0.0 107.96 170.538 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.1 p -152.4 155.48 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-N 119.454 1.024 . . . . 0.0 109.524 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.45 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -90.1 121.77 32.46 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 120.109 1.322 . . . . 0.0 109.186 176.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.43 -10.16 41.17 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -166.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -117.39 2.89 12.52 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.838 1.255 . . . . 0.0 110.903 -178.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.45 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 22.5 t0 -135.55 38.53 2.87 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 128.86 2.864 . . . . 0.0 106.902 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -64.74 -12.88 51.91 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 120.653 -1.279 . . . . 0.0 113.271 -163.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -107.83 3.81 24.79 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 127.94 2.496 . . . . 0.0 112.346 177.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.36 -78.37 0.98 Allowed Glycine 0 C--N 1.336 0.535 0 N-CA-C 110.239 -1.144 . . . . 0.0 110.239 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 20.7 m -121.64 156.81 32.21 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.463 1.105 . . . . 0.0 109.817 -174.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.4 tt -152.39 152.88 10.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.525 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 163.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 80.4 mt -133.59 117.79 28.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 172.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -84.17 153.87 23.42 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 170.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.7 p90 -155.34 162.85 40.73 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 120.924 -1.11 . . . . 0.0 110.265 165.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -145.12 129.11 17.48 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 117.971 0.35 . . . . 0.0 111.031 162.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HA ' HG22 ' A' ' 91' ' ' VAL . . . -71.32 118.65 14.38 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.707 0.803 . . . . 0.0 109.865 164.073 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -131.23 76.01 1.69 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.752 2.421 . . . . 0.0 106.138 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.16 -129.46 9.68 Favored Glycine 0 C--N 1.338 0.686 0 C-N-CA 124.684 1.135 . . . . 0.0 112.142 174.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -88.45 22.29 2.59 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.107 1.453 . . . . 0.0 112.129 170.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 93.9 m -137.16 148.37 46.55 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.945 1.698 . . . . 0.0 108.082 176.068 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.415 HG22 ' HA ' ' A' ' 86' ' ' ALA . 61.5 t -118.76 129.03 75.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 167.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 19.8 mm -91.39 108.32 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 105.009 -2.219 . . . . 0.0 105.009 169.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.402 HG21 HG13 ' A' ' 36' ' ' ILE . 8.8 mt -89.85 141.96 13.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 173.155 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.445 ' HB3' HD13 ' A' ' 103' ' ' LEU . 68.2 mttt -136.34 100.43 4.38 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 125.473 1.509 . . . . 0.0 108.17 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.422 ' CE1' HD12 ' A' ' 36' ' ' ILE . 34.9 p90 -115.6 165.89 12.52 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 122.75 0.42 . . . . 0.0 111.034 -174.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.505 HG23 ' O ' ' A' ' 98' ' ' GLN . 9.2 t -146.51 171.76 14.58 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 125.801 1.64 . . . . 0.0 107.573 172.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 53.0 p -106.45 19.7 20.11 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.399 1.479 . . . . 0.0 110.253 169.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.505 ' O ' HG23 ' A' ' 96' ' ' THR . 8.0 mm-40 -127.91 -171.46 2.45 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.775 0.83 . . . . 0.0 109.217 167.165 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.71 -25.56 23.4 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 169.254 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.7 p30 -142.65 15.76 1.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -149.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.9 p -119.03 -179.92 3.97 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 119.754 1.161 . . . . 0.0 113.762 -170.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -53.22 125.4 17.43 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 123.666 0.786 . . . . 0.0 110.099 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 94' ' ' LYS . 58.6 mt -79.61 159.56 26.74 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 125.59 1.556 . . . . 0.0 109.043 -179.033 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -82.08 177.4 8.84 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 125.162 1.385 . . . . 0.0 110.162 171.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.37 119.76 35.57 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.256 1.422 . . . . 0.0 109.948 171.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.3 tptt -144.83 132.62 21.17 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 170.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -138.85 105.45 5.33 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 106.195 -1.779 . . . . 0.0 106.195 -171.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -118.22 145.44 44.99 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -174.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 37.4 p -75.02 153.05 38.66 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.332 0.515 . . . . 0.0 111.917 176.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.3 mt -60.5 -23.94 64.92 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 121.814 -0.554 . . . . 0.0 110.515 168.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.94 -46.41 71.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.321 172.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -51.41 -65.39 0.56 Allowed 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.462 1.105 . . . . 0.0 110.304 176.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.74 -34.87 73.51 Favored 'General case' 0 CA--C 1.521 -0.137 0 C-N-CA 122.781 0.432 . . . . 0.0 111.878 -170.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -69.74 -34.03 73.27 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.906 -0.496 . . . . 0.0 109.834 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -53.92 12.29 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.982 174.337 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -53.43 -56.74 14.37 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.14 0.976 . . . . 0.0 110.706 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -124.09 11.62 8.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.167 0.987 . . . . 0.0 113.171 -160.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -143.99 23.46 1.7 Allowed 'General case' 0 CA--C 1.537 0.454 0 O-C-N 120.525 -1.359 . . . . 0.0 114.475 175.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 6.8 pm0 -69.53 -40.29 76.99 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 120.27 -1.519 . . . . 0.0 114.418 -171.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.8 t -107.05 173.57 6.27 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 126.369 1.868 . . . . 0.0 109.048 -163.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 2.2 mtm-85 -79.65 -47.85 14.71 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 124.104 0.961 . . . . 0.0 112.593 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.0 m -57.42 -37.61 73.03 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.731 0.645 . . . . 0.0 110.519 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -62.33 -29.79 70.7 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.454 -0.779 . . . . 0.0 111.796 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 29.4 mtpt -65.68 -33.49 76.01 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 118.047 -0.977 . . . . 0.0 109.801 -178.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -49.38 78.04 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 176.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -69.63 -56.84 6.14 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 118.633 -0.698 . . . . 0.0 110.202 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 53.5 t -49.32 -53.31 9.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 123.882 0.873 . . . . 0.0 110.826 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -71.59 -17.56 62.28 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.731 0.696 . . . . 0.0 112.043 -177.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -80.7 -29.94 36.44 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.24 -0.912 . . . . 0.0 111.126 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -64.37 -36.64 84.79 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 167.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 26.1 t -64.68 -23.47 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 121.04 -1.038 . . . . 0.0 110.653 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -89.73 15.32 9.87 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.782 -1.199 . . . . 0.0 112.25 174.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -136.23 9.31 4.12 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 124.693 1.139 . . . . 0.0 114.258 -174.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.2 22.88 11.93 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -161.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.755 ' HB3' HG23 ' A' ' 51' ' ' VAL . 19.2 mtt180 44.26 -164.04 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 130.675 3.59 . . . . 0.0 110.773 179.289 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.36 -5.12 0.39 Allowed 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 118.892 -1.123 . . . . 0.0 112.685 159.115 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 . . . . . 0 C--O 1.254 1.322 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 -173.016 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.147 0 N-CA-C 111.785 -0.526 . . . . 0.0 111.785 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 -66.98 5.08 0.72 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -175.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 6.3 ttp -61.57 -32.44 72.53 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.395 1.878 . . . . 0.0 113.792 -171.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.1 tttp 54.77 -162.16 0.14 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.109 0.964 . . . . 0.0 112.337 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -103.06 160.68 14.41 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 148.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.0 p -120.26 170.68 9.11 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 165.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -62.65 -43.53 98.58 Favored 'General case' 0 C--O 1.233 0.22 0 O-C-N 121.743 -0.598 . . . . 0.0 110.078 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -48.83 80.06 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 123.987 0.915 . . . . 0.0 109.977 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.8 mm-40 -55.55 -47.36 76.46 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 125.49 1.516 . . . . 0.0 110.391 -175.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.4 mt -64.15 -33.41 62.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -178.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -65.88 -30.84 77.95 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-O 118.957 -0.913 . . . . 0.0 113.871 178.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.446 HG21 HG22 ' A' ' 131' ' ' VAL . 61.6 t -75.89 -44.75 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mp -55.42 -45.46 76.75 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.008 0.523 . . . . 0.0 110.449 173.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.46 -42.46 96.21 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.942 0.497 . . . . 0.0 111.672 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.33 -20.75 79.55 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 112.115 -0.394 . . . . 0.0 112.115 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.6 mp -69.77 -26.87 64.5 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.985 -1.303 . . . . 0.0 111.803 173.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.428 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -80.88 -27.56 36.26 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 171.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.428 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.3 mp -127.08 95.18 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -174.021 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m 67.51 63.5 0.73 Allowed Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.398 1.479 . . . . 0.0 113.009 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.94 -42.4 37.56 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.243 2.628 . . . . 0.0 111.721 176.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.12 -42.71 75.7 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.408 -0.807 . . . . 0.0 110.563 -173.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' TRP . . . . . 0.463 ' HA ' ' HG2' ' A' ' 43' ' ' GLN . 37.6 t90 -60.04 -37.58 80.21 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.087 0.555 . . . . 0.0 111.604 175.01 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.31 -63.32 1.34 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 172.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -55.13 -36.83 66.17 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 123.585 0.754 . . . . 0.0 112.286 -173.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.463 ' HG2' ' HA ' ' A' ' 40' ' ' TRP 0.252 1.5 pt20 -64.59 -45.15 88.2 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 118.193 0.452 . . . . 0.0 111.166 -176.32 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -69.06 -34.16 74.73 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 124.157 0.983 . . . . 0.0 110.616 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.7 mm -58.87 -45.18 91.82 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.494 166.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.03 -4.3 4.54 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -177.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.57 10.08 7.19 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.276 1.03 . . . . 0.0 111.658 170.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 49.14 31.29 3.42 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.439 2.295 . . . . 0.0 113.111 -173.312 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -91.13 3.37 54.95 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.196 1.799 . . . . 0.0 115.657 -174.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.457 HD21 HD22 ' A' ' 71' ' ' LEU . 55.5 tp -87.47 139.53 30.45 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.099 1.318 . . . . 0.0 110.758 -177.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 71.8 t -114.33 123.62 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 C-N-CA 124.856 1.263 . . . . 0.0 107.69 165.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -71.93 135.16 46.4 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.269 1.428 . . . . 0.0 107.791 156.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -147.24 167.59 28.44 Favored Glycine 0 C--N 1.333 0.406 0 CA-C-N 118.633 0.652 . . . . 0.0 112.281 175.537 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 20.0 mm -117.49 134.38 61.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 106.153 -1.795 . . . . 0.0 106.153 173.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.668 HG13 HG11 ' A' ' 61' ' ' VAL . 28.8 t -47.91 -71.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 C-N-CA 128.194 2.597 . . . . 0.0 110.089 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 21.2 mttt 58.65 159.03 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.517 0 C-N-CA 127.115 2.166 . . . . 0.0 113.276 -166.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.69 -12.32 30.95 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 121.872 1.715 . . . . 0.0 111.732 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -60.87 -14.18 20.43 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.214 1.405 . . . . 0.0 112.509 175.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -131.38 -173.53 3.14 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 120.237 1.381 . . . . 0.0 112.264 -173.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 24.6 m -129.2 101.69 6.13 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.744 1.218 . . . . 0.0 107.803 -149.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.668 HG11 HG13 ' A' ' 55' ' ' VAL . 4.9 m -142.96 157.19 61.49 Favored Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 124.977 1.311 . . . . 0.0 110.859 -154.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -67.24 172.04 10.63 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 122.279 1.986 . . . . 0.0 111.573 175.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.52 141.33 57.91 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.775 0.83 . . . . 0.0 111.366 176.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.61 43.16 45.0 Favored Glycine 0 CA--C 1.485 -1.791 0 C-N-CA 124.299 0.952 . . . . 0.0 113.234 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.683 HG23 ' HB2' ' A' ' 68' ' ' TYR 0.252 1.6 p -170.37 80.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.416 -2.135 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 177.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -98.82 -6.64 28.82 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.015 -1.448 . . . . 0.0 112.235 162.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -152.4 -1.64 0.27 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -168.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.683 ' HB2' HG23 ' A' ' 65' ' ' VAL . 3.3 m-85 -67.92 115.66 7.69 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 119.657 1.117 . . . . 0.0 108.343 178.208 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -53.8 139.16 33.98 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.777 1.231 . . . . 0.0 109.948 -177.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 22.3 p90 -122.38 167.15 13.64 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.353 0.661 . . . . 0.0 112.665 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.457 HD22 HD21 ' A' ' 50' ' ' LEU . 54.0 mt -143.22 125.71 15.77 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 127.336 2.254 . . . . 0.0 106.47 -174.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.6 p -157.39 155.52 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 125.144 1.378 . . . . 0.0 108.397 -178.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.87 157.17 16.92 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.416 1.007 . . . . 0.0 110.422 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.01 -25.62 63.82 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 -166.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -106.71 -8.65 16.77 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 124.549 1.14 . . . . 0.0 112.339 -174.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.6 p30 -123.48 32.55 5.6 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.905 0.882 . . . . 0.0 109.233 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -51.72 -22.42 3.5 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.197 0.999 . . . . 0.0 113.556 173.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -116.47 6.43 13.57 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.77 1.628 . . . . 0.0 112.877 175.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.82 -126.13 1.75 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 126.39 1.948 . . . . 0.0 110.553 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.0 m -64.2 160.1 19.24 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 170.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.2 tt -157.46 147.8 10.24 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 160.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 88.9 mt -126.99 135.46 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -119.61 157.14 29.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 126.012 1.725 . . . . 0.0 106.983 176.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -159.72 153.81 23.4 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 120.425 -1.422 . . . . 0.0 108.906 172.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.79 110.68 13.36 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 166.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.74 84.32 0.9 Allowed 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 161.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -75.96 -169.53 1.14 Allowed 'General case' 0 C--O 1.24 0.555 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.62 104.56 0.39 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 124.19 0.9 . . . . 0.0 111.007 178.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 62.55 14.72 7.3 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.323 1.449 . . . . 0.0 111.614 168.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.0 m -144.44 138.96 28.06 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.571 1.948 . . . . 0.0 107.985 -172.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 18.5 t -115.38 112.03 38.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 169.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.429 HD12 ' H ' ' A' ' 92' ' ' ILE . 4.2 mp -86.64 104.12 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 N-CA-C 105.726 -1.953 . . . . 0.0 105.726 166.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 mt -86.54 113.78 24.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -108.4 98.7 8.19 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 126.32 1.848 . . . . 0.0 108.63 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -124.25 165.89 16.85 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 119.925 -1.735 . . . . 0.0 110.533 -175.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.5 t -154.22 171.27 19.47 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.635 1.574 . . . . 0.0 108.774 -177.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.5 -11.74 19.07 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.651 1.58 . . . . 0.0 111.288 174.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -147.6 145.51 29.03 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.15 176.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.0 tpt85 -53.8 -41.35 67.2 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.139 0.976 . . . . 0.0 109.796 173.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 39.4 p30 -78.56 26.68 0.22 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.489 1.515 . . . . 0.0 114.94 176.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.95 158.6 43.9 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 119.753 -1.842 . . . . 0.0 112.131 172.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 103' ' ' LEU . 3.4 tptm -63.29 166.68 6.02 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 124.397 1.079 . . . . 0.0 109.616 169.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.416 ' H ' ' HG3' ' A' ' 102' ' ' LYS . 26.5 mt -105.88 156.52 18.27 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 125.822 1.649 . . . . 0.0 108.613 -172.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -71.79 -179.28 2.59 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.652 1.181 . . . . 0.0 109.563 165.168 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -142.99 70.84 1.33 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.18 0.992 . . . . 0.0 108.647 167.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -70.64 101.14 1.98 Allowed 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 170.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -95.3 136.29 35.84 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 175.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 29.1 mt -146.89 153.95 40.73 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.391 1.876 . . . . 0.0 106.334 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 11.9 p -76.53 154.8 34.25 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.501 -0.749 . . . . 0.0 111.2 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 11.8 mt -59.96 -25.52 65.26 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.188 -0.945 . . . . 0.0 110.531 169.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.23 -46.29 70.91 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 117.264 -1.35 . . . . 0.0 112.607 170.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.95 -60.19 2.4 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.067 1.347 . . . . 0.0 110.079 177.471 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.17 -42.22 85.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.345 1.458 . . . . 0.0 110.54 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -66.44 -34.07 77.12 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.471 -0.768 . . . . 0.0 110.257 -178.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.15 -66.58 0.54 Allowed 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 175.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -49.74 -42.15 45.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 126.584 1.954 . . . . 0.0 114.333 -166.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -128.1 18.51 6.56 Favored 'General case' 0 C--O 1.226 -0.146 0 CA-C-N 118.181 0.446 . . . . 0.0 111.636 -173.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -142.71 17.17 1.99 Allowed 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.631 -0.668 . . . . 0.0 111.359 177.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -51.05 -74.13 0.03 OUTLIER 'General case' 0 C--N 1.351 0.663 0 CA-C-N 119.313 0.961 . . . . 0.0 111.801 165.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.64 151.04 27.8 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 -169.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 62.5 ttt-85 -75.86 -21.43 57.22 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-O 117.702 -1.142 . . . . 0.0 112.382 173.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 1.4 t -59.66 -50.25 74.6 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 119.933 1.242 . . . . 0.0 108.179 175.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -61.65 -24.89 67.02 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.229 0.468 . . . . 0.0 111.917 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -69.93 -5.19 24.36 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 118.031 -0.985 . . . . 0.0 112.677 176.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? -70.97 -75.54 0.12 Allowed 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 155.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -55.57 -47.3 76.64 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -162.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 71.2 t -55.1 -51.36 55.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 125.091 1.356 . . . . 0.0 110.194 177.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.17 -27.42 60.81 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.93 0.892 . . . . 0.0 110.926 -177.155 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.61 -51.26 70.56 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.543 2.337 . . . . 0.0 108.542 169.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -57.31 -27.96 62.64 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.577 0.751 . . . . 0.0 111.394 -178.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.446 HG22 HG21 ' A' ' 30' ' ' VAL . 60.2 t -75.36 -25.62 18.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 O-C-N 121.205 -0.935 . . . . 0.0 112.171 177.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -90.8 -18.11 25.46 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.457 -0.777 . . . . 0.0 111.159 173.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.31 9.91 73.4 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.063 1.316 . . . . 0.0 114.658 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.424 ' HB3' HD23 ' A' ' 50' ' ' LEU . 3.8 pp -104.65 167.64 9.6 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.968 1.307 . . . . 0.0 111.667 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 49.8 mtp85 -109.53 176.71 4.98 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 125.47 1.508 . . . . 0.0 108.671 172.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.82 3.94 1.87 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.752 0.421 . . . . 0.0 111.216 -169.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 . . . . . 0 C--O 1.246 0.915 0 C-N-CA 129.113 2.965 . . . . 0.0 109.839 -158.987 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.806 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.8 m80 55.27 178.23 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.176 1.79 . . . . 0.0 113.332 -165.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 43.9 mmm -48.59 103.95 0.05 Allowed 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 126.937 2.095 . . . . 0.0 108.779 169.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -150.59 -172.76 4.27 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 174.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.58 -166.23 2.34 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 171.366 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.15 137.71 54.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.508 1.523 . . . . 0.0 107.956 175.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -69.58 -40.09 76.94 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.757 -0.59 . . . . 0.0 110.282 -166.062 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -45.6 -51.05 12.62 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.37 1.468 . . . . 0.0 110.231 165.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -69.59 -37.39 76.9 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.561 1.144 . . . . 0.0 112.053 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.7 mt -62.52 -36.49 75.21 Favored 'Isoleucine or valine' 0 C--N 1.342 0.278 0 CA-C-N 120.499 1.5 . . . . 0.0 110.909 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -51.85 -48.13 51.83 Favored Glycine 0 C--N 1.336 0.571 0 CA-C-N 119.65 1.113 . . . . 0.0 112.827 -174.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.4 t -62.26 -46.23 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-N 117.226 0.513 . . . . 0.0 110.084 -178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.491 HD21 HG11 ' A' ' 127' ' ' VAL . 80.6 mt -70.68 -34.09 71.61 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.327 0.651 . . . . 0.0 111.436 -176.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.26 -48.46 78.08 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.04 0.936 . . . . 0.0 109.631 171.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.75 -34.62 78.15 Favored Glycine 0 C--N 1.336 0.578 0 N-CA-C 111.644 -0.582 . . . . 0.0 111.644 175.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.1 mt -63.78 -31.06 72.11 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 120.607 -1.525 . . . . 0.0 110.794 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.14 -19.14 57.27 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 117.592 -1.194 . . . . 0.0 113.252 172.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.0 mm -144.4 93.0 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 125.905 1.682 . . . . 0.0 108.085 -163.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t 56.27 71.66 1.15 Allowed Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 126.5 1.92 . . . . 0.0 111.629 -171.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -60.58 -42.88 36.42 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.447 2.098 . . . . 0.0 109.208 171.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.86 -56.23 13.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.195 1.398 . . . . 0.0 110.99 177.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 69.3 t90 -53.07 -53.21 53.66 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.543 0.61 . . . . 0.0 110.214 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.7 tt -59.1 -48.26 82.26 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 118.438 0.563 . . . . 0.0 110.678 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.0 mttm -56.0 -45.55 79.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 118.679 0.672 . . . . 0.0 110.589 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -69.3 -39.57 78.22 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -175.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -65.27 -46.84 78.85 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.391 -0.818 . . . . 0.0 111.257 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.6 mm -60.87 -35.29 63.71 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.114 0 C-N-CA 123.9 0.88 . . . . 0.0 110.416 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.48 -39.76 58.16 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.03 0.832 . . . . 0.0 111.319 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -100.98 6.23 43.45 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.013 1.725 . . . . 0.0 113.302 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 54.27 19.39 2.19 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.199 1.799 . . . . 0.0 112.147 -171.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -83.25 10.01 9.41 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 119.984 -1.698 . . . . 0.0 112.128 -178.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.4 tp -84.85 145.92 27.58 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 171.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.579 HG23 ' CB ' ' A' ' 135' ' ' ARG . 3.5 p -128.45 165.52 27.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 125.119 1.368 . . . . 0.0 108.876 167.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -134.11 159.31 41.23 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 128.874 2.87 . . . . 0.0 105.801 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.59 175.51 43.98 Favored Glycine 0 CA--C 1.517 0.184 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 177.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 42.2 mm -113.8 134.68 55.84 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.715 0 C-N-CA 126.463 1.905 . . . . 0.0 106.589 178.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.525 HG12 HG11 ' A' ' 61' ' ' VAL . 0.4 OUTLIER -44.51 -82.96 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.421 -1.919 1 C-N-CA 132.063 4.145 . . . . 0.0 111.718 169.067 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.515 ' H ' HG23 ' A' ' 55' ' ' VAL . 15.1 mmtt 60.33 166.24 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 124.838 1.255 . . . . 0.0 112.551 -173.572 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -65.08 -6.91 13.94 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.341 2.027 . . . . 0.0 115.256 167.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.2 m -91.92 -48.52 6.72 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 120.086 1.312 . . . . 0.0 113.872 -166.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.73 169.89 16.41 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.385 0.993 . . . . 0.0 108.972 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.8 m -80.13 108.52 13.79 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 174.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.525 HG11 HG12 ' A' ' 55' ' ' VAL . 2.6 m -131.89 163.19 51.7 Favored Pre-proline 0 C--O 1.238 0.472 0 C-N-CA 125.292 1.437 . . . . 0.0 108.972 167.378 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -75.6 164.06 32.91 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 121.572 1.515 . . . . 0.0 111.695 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.13 123.43 15.24 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.332 169.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 105.35 26.92 6.03 Favored Glycine 0 CA--C 1.529 0.911 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.026 172.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.1 m -144.21 81.77 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.51 1.524 . . . . 0.0 108.478 172.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -89.85 -14.42 34.39 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.15 1.908 . . . . 0.0 116.15 -172.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -165.32 14.9 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 126.863 2.065 . . . . 0.0 110.599 -176.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.426 ' CG ' ' HB2' ' A' ' 85' ' ' LYS . 10.3 m-85 -77.13 110.12 11.55 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 175.748 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.3 m -49.99 139.05 14.5 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.36 0.664 . . . . 0.0 109.483 168.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 83' ' ' PHE . 36.8 p90 -112.29 170.38 8.21 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.099 0.863 . . . . 0.0 110.703 174.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.9 mt -135.3 135.9 41.18 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.0 2.12 . . . . 0.0 106.241 169.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.547 ' HB ' HG13 ' A' ' 81' ' ' ILE . 4.1 p -144.41 162.24 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 CA-C-N 119.398 0.999 . . . . 0.0 108.727 175.572 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.67 122.82 28.64 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 172.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.06 -30.76 71.34 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 119.085 0.857 . . . . 0.0 110.906 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.85 -10.13 29.7 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 124.359 1.064 . . . . 0.0 112.236 -176.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.16 53.73 1.96 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 176.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -47.72 -46.4 29.63 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.918 -0.489 . . . . 0.0 112.271 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -85.75 2.63 44.74 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.937 1.295 . . . . 0.0 111.969 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.5 -69.13 1.36 Allowed Glycine 0 CA--C 1.532 1.097 0 C-N-CA 126.261 1.886 . . . . 0.0 113.893 -165.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.7 m -143.47 158.72 43.42 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.451 1.5 . . . . 0.0 109.206 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.547 HG13 ' HB ' ' A' ' 72' ' ' VAL . 7.3 tt -155.51 155.11 5.97 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-N 119.315 0.961 . . . . 0.0 109.118 177.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.4 mt -139.02 150.59 23.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 175.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 70' ' ' TYR . 50.3 m-85 -128.86 153.77 47.14 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 126.202 1.801 . . . . 0.0 107.592 171.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -152.03 158.5 43.15 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.819 1.248 . . . . 0.0 109.793 175.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.426 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 10.3 tttt -155.62 125.53 6.53 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 123.996 0.919 . . . . 0.0 108.898 176.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.2 158.15 32.03 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.141 0.428 . . . . 0.0 110.646 167.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -137.87 -3.65 1.81 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 177.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 113.17 81.46 1.07 Allowed Glycine 0 C--N 1.338 0.643 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 75.44 7.55 3.96 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.189 2.596 . . . . 0.0 114.527 -173.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.1 m -141.0 160.49 39.96 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.714 1.605 . . . . 0.0 108.064 174.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 87.9 t -134.23 139.77 47.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 C-N-CA 126.324 1.85 . . . . 0.0 106.371 174.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 23.8 mm -103.15 114.82 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 173.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.8 mt -94.12 130.91 42.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 173.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -125.02 97.71 5.37 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 126.994 2.118 . . . . 0.0 107.192 -176.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 25.0 p90 -124.76 169.79 11.66 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.508 -1.37 . . . . 0.0 110.094 -171.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.4 t -154.31 168.36 26.85 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.301 0.64 . . . . 0.0 109.498 176.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.0 p -91.1 -10.59 41.44 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.779 1.632 . . . . 0.0 112.244 170.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -147.17 123.25 10.78 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.385 1.074 . . . . 0.0 110.236 -170.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 -51.99 -36.03 48.46 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 125.113 1.365 . . . . 0.0 111.695 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.03 -3.48 32.75 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.947 1.699 . . . . 0.0 114.925 -173.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.4 p -119.95 171.92 8.1 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -162.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.05 152.03 41.4 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 121.287 -0.883 . . . . 0.0 109.264 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -85.53 135.37 33.85 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 172.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.72 176.12 0.41 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.266 1.427 . . . . 0.0 109.391 162.244 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.28 106.0 4.48 Favored 'General case' 0 C--O 1.232 0.181 0 O-C-N 121.355 -0.84 . . . . 0.0 109.561 -175.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.451 ' HG2' HD21 ' A' ' 108' ' ' LEU . 2.5 tppt? -121.66 108.08 13.13 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 106.363 -1.718 . . . . 0.0 106.363 171.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -81.27 140.74 34.67 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 169.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.451 HD21 ' HG2' ' A' ' 106' ' ' LYS . 3.0 mm? -135.3 135.96 41.23 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 106.819 -1.548 . . . . 0.0 106.819 171.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.37 153.81 33.94 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.718 0.807 . . . . 0.0 109.648 172.142 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.0 mt -55.68 -43.12 76.06 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.268 -1.52 . . . . 0.0 108.46 166.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.9 t -51.67 -55.09 21.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.902 -0.57 . . . . 0.0 109.959 177.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -44.53 -66.34 0.4 Allowed 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 127.568 2.347 . . . . 0.0 110.48 175.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 83.4 mt -64.14 -31.65 72.93 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.665 -175.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -70.29 -39.71 74.71 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.959 -1.088 . . . . 0.0 108.225 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -51.02 61.16 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 117.885 -1.055 . . . . 0.0 108.623 174.371 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -55.68 -44.81 77.65 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 118.774 0.715 . . . . 0.0 111.705 -174.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -141.85 16.36 2.13 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -157.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -148.49 42.01 0.98 Allowed 'General case' 0 C--O 1.238 0.453 0 O-C-N 120.049 -1.657 . . . . 0.0 111.496 175.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.5 -26.47 13.23 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -170.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 41.5 p -92.49 -174.97 3.85 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.167 1.387 . . . . 0.0 109.765 -178.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.29 -46.64 4.96 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 120.545 -1.347 . . . . 0.0 110.768 -176.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 70.4 m -63.0 -31.01 72.05 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 119.133 0.879 . . . . 0.0 111.297 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -62.12 -16.83 55.23 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.75 -1.219 . . . . 0.0 112.9 177.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -65.35 -25.07 67.43 Favored 'General case' 0 N--CA 1.462 0.166 0 O-C-N 121.368 -0.832 . . . . 0.0 111.014 172.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -77.33 -67.67 0.69 Allowed 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 168.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -53.65 -51.76 62.12 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 124.458 1.098 . . . . 0.0 112.57 -157.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' VAL . . . . . 0.491 HG11 HD21 ' A' ' 31' ' ' LEU . 36.4 t -53.2 -55.48 12.38 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 C-N-CA 123.997 0.919 . . . . 0.0 109.216 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -67.59 -28.23 67.58 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -176.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -65.35 -38.32 89.75 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 124.553 1.141 . . . . 0.0 109.757 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 9.2 m-30 -62.47 -33.47 74.92 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.695 0.798 . . . . 0.0 111.146 169.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 11.2 t -70.24 -16.08 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 120.569 -1.332 . . . . 0.0 111.242 173.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -107.83 18.01 21.82 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.086 1.355 . . . . 0.0 110.757 173.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -122.39 18.98 8.18 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 125.658 1.599 . . . . 0.0 111.252 175.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.8 pp -125.48 151.23 46.56 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.279 1.032 . . . . 0.0 111.35 -178.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.579 ' CB ' HG23 ' A' ' 51' ' ' VAL . 19.1 mtt85 -72.32 178.5 3.9 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 126.98 2.112 . . . . 0.0 108.951 170.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.88 -0.89 2.05 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -175.243 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.256 1.417 0 C-N-CA 126.485 1.914 . . . . 0.0 108.138 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.125 -0.79 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -134.24 -55.34 0.86 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.295 1.438 . . . . 0.0 111.808 -175.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 27.4 ptm -122.6 -22.11 5.5 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.553 0.741 . . . . 0.0 111.983 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.5 mttm -79.54 101.27 8.17 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 168.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 61.39 169.3 0.1 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 126.695 1.998 . . . . 0.0 112.732 -169.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.6 p -129.69 154.59 47.0 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 104.711 -2.329 . . . . 0.0 104.711 162.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.611 ' HA ' HD12 ' A' ' 28' ' ' ILE . 2.9 m-20 -63.75 -32.64 74.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.768 0.258 . . . . 0.0 110.406 -170.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.527 ' NE2' ' H ' ' A' ' 26' ' ' GLN . 1.3 mp0 -58.63 -47.71 83.47 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.056 0.943 . . . . 0.0 111.252 175.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -62.76 -45.8 91.02 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.366 1.066 . . . . 0.0 109.289 -175.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.611 HD12 ' HA ' ' A' ' 25' ' ' ASP . 28.5 mt -61.52 -44.7 99.04 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 C-N-CA 124.817 1.247 . . . . 0.0 108.342 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.57 -37.57 56.64 Favored Glycine 0 CA--C 1.523 0.562 0 C-N-CA 124.168 0.89 . . . . 0.0 111.881 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 75.5 t -64.73 -59.77 3.71 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.137 0 CA-C-N 118.47 1.135 . . . . 0.0 109.042 173.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.43 ' CB ' HD22 ' A' ' 113' ' ' LEU . 33.9 mt -58.36 -42.48 87.03 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.432 1.014 . . . . 0.0 110.787 -172.22 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.26 93.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.64 1.176 . . . . 0.0 111.45 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.82 -25.19 75.85 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 118.164 0.438 . . . . 0.0 112.342 175.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.1 mt -69.99 -41.09 74.84 Favored 'General case' 0 C--O 1.231 0.125 0 O-C-N 120.449 -1.618 . . . . 0.0 110.008 173.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.33 -32.13 73.47 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 119.212 -0.423 . . . . 0.0 111.312 173.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.438 HG21 ' CG ' ' A' ' 95' ' ' TYR . 32.1 mm -126.75 97.74 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 125.908 1.683 . . . . 0.0 107.889 -170.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.276 1.0 OUTLIER 65.83 67.67 0.72 Allowed Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.066 1.746 . . . . 0.0 112.559 173.129 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.79 -35.73 9.16 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.261 2.641 . . . . 0.0 113.285 -176.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -58.97 -58.93 6.47 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.275 1.03 . . . . 0.0 110.104 -177.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 48.8 t90 -47.7 -49.7 27.17 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.481 1.512 . . . . 0.0 111.203 175.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.7 tt -58.86 -47.56 84.48 Favored 'General case' 0 C--N 1.34 0.155 0 O-C-N 121.624 -0.672 . . . . 0.0 110.343 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -63.24 -38.5 91.4 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 117.841 -1.076 . . . . 0.0 111.606 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -61.44 -40.1 93.23 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 119.625 1.102 . . . . 0.0 109.775 176.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -75.24 -45.51 39.73 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.16 -175.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.91 -45.3 98.52 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-N 119.487 1.039 . . . . 0.0 109.627 176.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.29 -39.26 72.41 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.807 0.73 . . . . 0.0 110.306 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.93 0.79 46.43 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 44.41 45.54 7.53 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 126.463 1.905 . . . . 0.0 111.003 -168.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -104.82 -2.31 24.93 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 177.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.0 tp -85.5 119.17 25.56 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 120.175 1.352 . . . . 0.0 110.638 -171.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 42.9 t -107.4 120.51 58.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 C-N-CA 125.544 1.538 . . . . 0.0 109.034 -178.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -89.94 153.3 20.72 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 128.124 2.57 . . . . 0.0 108.66 165.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -178.94 175.2 47.17 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 27.7 mm -115.12 136.3 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 124.599 1.159 . . . . 0.0 108.283 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.533 HG13 HG11 ' A' ' 61' ' ' VAL . 27.5 t -53.4 -75.82 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 129.925 3.29 . . . . 0.0 111.349 -175.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.0 mttt 59.27 167.37 0.08 OUTLIER Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 123.984 0.914 . . . . 0.0 112.191 -172.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.98 -4.47 8.93 Favored 'Trans proline' 0 CA--C 1.549 1.253 0 CA-C-N 121.104 1.43 . . . . 0.0 112.747 169.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.1 m -81.04 3.94 21.45 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 126.44 1.896 . . . . 0.0 114.989 -168.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.19 -175.42 4.1 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 120.002 1.273 . . . . 0.0 111.335 171.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.458 ' O ' HG13 ' A' ' 61' ' ' VAL . 8.9 t -75.51 143.8 42.32 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 162.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.533 HG11 HG13 ' A' ' 55' ' ' VAL . 0.4 OUTLIER -160.64 157.62 23.87 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 124.316 1.046 . . . . 0.0 110.296 165.583 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.36 -177.99 3.67 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 123.891 3.061 . . . . 0.0 111.379 174.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.71 137.2 40.47 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 123.639 0.776 . . . . 0.0 112.567 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.15 60.75 6.78 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 125.131 1.348 . . . . 0.0 109.874 173.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -144.16 30.59 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 125.536 1.535 . . . . 0.0 109.785 165.132 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -55.19 -15.76 2.6 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 117.7 2.481 . . . . 0.0 117.7 -160.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -154.6 26.74 0.45 Allowed 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.362 1.465 . . . . 0.0 110.488 171.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -71.96 108.85 5.42 Favored 'General case' 0 CA--C 1.519 -0.234 0 O-C-N 121.321 -0.862 . . . . 0.0 108.742 174.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.4 m -50.24 137.69 17.7 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.235 1.414 . . . . 0.0 109.846 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 23.8 p90 -118.97 160.8 21.32 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 118.71 0.686 . . . . 0.0 111.33 -177.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.0 mt -135.82 133.78 38.2 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 127.566 2.346 . . . . 0.0 106.43 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.9 p -161.72 167.87 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 105.161 -2.163 . . . . 0.0 105.161 -169.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.06 -175.93 4.83 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.999 -1.063 . . . . 0.0 108.67 169.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -93.18 -14.46 27.12 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.6 -0.688 . . . . 0.0 112.759 161.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -139.28 22.21 2.57 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.932 0.893 . . . . 0.0 112.166 -161.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -138.17 34.45 2.33 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.8 1.64 . . . . 0.0 107.926 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -60.99 -18.79 59.52 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 119.651 -1.905 . . . . 0.0 113.473 -160.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -98.73 3.47 47.63 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.786 1.634 . . . . 0.0 113.779 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -94.96 -128.84 5.53 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 125.931 1.729 . . . . 0.0 111.679 -171.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 25.4 m -70.75 156.28 39.71 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.595 -0.944 . . . . 0.0 109.069 173.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.3 tt -151.03 158.92 4.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 164.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 57.9 mt -136.07 143.12 36.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 106.055 -1.831 . . . . 0.0 106.055 174.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -122.21 154.98 36.78 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 172.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -156.69 158.82 37.65 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.24 -0.912 . . . . 0.0 108.918 169.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.4 tttt -142.19 109.35 5.54 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 160.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.589 ' HB3' HD13 ' A' ' 28' ' ' ILE . . . -82.69 149.93 27.05 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 165.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -141.64 -154.12 0.5 Allowed 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 128.352 2.661 . . . . 0.0 107.144 -171.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -68.97 89.29 0.24 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 125.073 1.32 . . . . 0.0 110.026 -176.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 62.22 11.0 4.13 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.989 2.116 . . . . 0.0 114.149 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.89 162.9 24.83 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.515 1.507 . . . . 0.0 108.934 174.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 107' ' ' ALA . 8.4 p -146.82 151.86 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.145 0 C-N-CA 124.811 1.245 . . . . 0.0 108.06 168.669 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.422 HG22 ' HG3' ' A' ' 94' ' ' LYS . 3.4 mp -116.53 109.45 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 166.135 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.2 mt -83.04 127.54 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 165.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.422 ' HG3' HG22 ' A' ' 92' ' ' ILE . 75.7 mttt -120.15 105.29 10.84 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.417 1.887 . . . . 0.0 109.017 178.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.438 ' CG ' HG21 ' A' ' 36' ' ' ILE . 26.7 p90 -126.02 167.68 14.99 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.858 -1.151 . . . . 0.0 110.461 -176.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -156.79 163.59 39.06 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.574 1.55 . . . . 0.0 107.303 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 45.5 p -82.21 -17.32 46.54 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 169.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -145.43 133.17 21.08 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.94 -41.58 11.76 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 129.38 3.072 . . . . 0.0 111.312 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -81.66 7.16 13.07 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -175.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.8 p -136.71 132.61 35.11 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.018 -1.677 . . . . 0.0 111.914 -169.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.414 ' HD2' ' H ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -53.65 147.27 11.67 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.432 1.093 . . . . 0.0 112.712 -166.034 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.444 ' H ' HD22 ' A' ' 103' ' ' LEU . 1.8 mm? -71.1 163.61 27.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.568 1.547 . . . . 0.0 111.79 -172.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.3 mptp? -84.17 177.39 8.24 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 127.454 2.302 . . . . 0.0 109.332 167.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -123.95 118.81 27.88 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.221 1.808 . . . . 0.0 107.955 171.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -127.62 126.47 42.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 103.967 -2.605 . . . . 0.0 103.967 164.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.41 ' HA ' ' O ' ' A' ' 91' ' ' VAL . . . -123.86 130.29 52.36 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 120.924 1.693 . . . . 0.0 108.914 179.565 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 29.2 mt -134.48 155.88 49.59 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 -173.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.5 p -87.18 151.0 23.56 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 121.282 1.856 . . . . 0.0 109.107 170.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 16.6 mt -58.66 -40.4 83.38 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-O 121.762 0.791 . . . . 0.0 109.755 -176.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.3 -37.33 82.82 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 124.407 1.083 . . . . 0.0 110.914 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -57.77 11.09 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 125.931 1.692 . . . . 0.0 112.255 173.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' LEU . . . . . 0.575 HD23 ' OE2' ' A' ' 116' ' ' GLU . 14.7 mt -56.35 -33.01 65.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.702 1.137 . . . . 0.0 110.136 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -72.59 12.1 0.53 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.127 1.371 . . . . 0.0 113.713 175.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.26 -35.02 1.04 Allowed 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.945 1.698 . . . . 0.0 110.86 -176.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.575 ' OE2' HD23 ' A' ' 113' ' ' LEU . 2.4 pt-20 -61.91 -86.41 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 154.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.493 ' CD2' ' HB2' ' A' ' 116' ' ' GLU . 98.7 m-85 -90.82 18.57 6.37 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.724 0.773 . . . . 0.0 110.233 -162.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -147.23 100.18 3.24 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 174.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -132.33 -33.56 1.28 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.8 t -130.95 143.31 50.63 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 120.827 1.649 . . . . 0.0 110.441 -168.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -62.14 -36.59 82.26 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 119.756 -1.84 . . . . 0.0 112.334 -171.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 26.9 t -62.52 -20.1 64.28 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 117.23 -1.367 . . . . 0.0 112.934 176.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -66.32 -23.37 66.35 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 121.046 1.748 . . . . 0.0 111.508 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.7 mttt -60.61 -6.35 1.63 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 126.335 1.854 . . . . 0.0 113.342 -175.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -104.56 -8.82 18.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 122.903 1.335 . . . . 0.0 114.122 -176.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.95 -62.66 1.56 Allowed 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 127.272 2.229 . . . . 0.0 108.916 176.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.8 t -57.69 -42.77 82.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 124.409 1.084 . . . . 0.0 111.467 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -76.27 -13.79 60.15 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 171.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -79.47 -41.72 26.87 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 125.051 1.34 . . . . 0.0 112.849 -179.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -59.02 -29.23 67.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.912 0.485 . . . . 0.0 110.29 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.3 t -67.03 -26.82 37.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 123.926 0.89 . . . . 0.0 111.437 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -96.96 -16.46 20.62 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.82 0.736 . . . . 0.0 111.849 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.43 -7.38 76.13 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.705 0.684 . . . . 0.0 112.878 -179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -84.81 176.19 8.67 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.902 1.281 . . . . 0.0 109.757 167.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -139.06 165.85 26.05 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 127.101 2.16 . . . . 0.0 108.368 -175.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.11 21.52 6.26 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.838 0.855 . . . . 0.0 110.459 178.39 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 . . . . . 0 C--O 1.251 1.153 0 C-N-CA 129.839 3.256 . . . . 0.0 110.249 -160.288 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.756 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 43.3 m80 -53.73 -72.79 0.05 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.071 0.948 . . . . 0.0 112.157 -174.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 46.7 mtp -81.46 175.92 10.13 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.744 -0.598 . . . . 0.0 111.358 -174.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.435 ' HA ' ' HE2' ' A' ' 22' ' ' LYS . 1.4 mmpt? -121.53 168.18 12.03 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.171 1.388 . . . . 0.0 108.046 160.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 57.54 -168.61 0.12 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.135 1.374 . . . . 0.0 109.498 -173.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.6 146.6 48.11 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 128.075 2.55 . . . . 0.0 106.143 171.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -55.86 -39.89 72.13 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.867 0.467 . . . . 0.0 110.45 -171.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -45.48 94.56 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.175 0.898 . . . . 0.0 110.511 -176.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.5 mm-40 -61.01 -34.93 75.59 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 124.835 1.254 . . . . 0.0 110.817 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 96.6 mt -74.05 -41.14 52.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 C-N-CA 124.517 1.127 . . . . 0.0 109.748 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.58 -42.49 90.49 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 124.967 1.27 . . . . 0.0 111.797 -175.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.3 t -60.82 -45.45 97.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-N 117.107 0.454 . . . . 0.0 110.742 176.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 46.1 mt -63.61 -45.37 90.61 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.933 0.788 . . . . 0.0 109.593 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.54 -47.45 73.16 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.386 1.075 . . . . 0.0 110.251 176.303 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.41 -22.67 78.81 Favored Glycine 0 CA--C 1.523 0.579 0 O-C-N 121.696 -0.627 . . . . 0.0 112.504 178.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 38' ' ' PRO . 2.1 tp -69.61 -17.79 63.56 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.052 1.926 . . . . 0.0 112.207 174.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.438 ' HB2' ' HE2' ' A' ' 117' ' ' PHE . . . -91.26 -20.88 21.43 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 117.012 -1.47 . . . . 0.0 113.083 170.111 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.5 mp -134.28 105.58 6.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 -176.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.287 2.3 p 57.31 62.06 5.9 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.665 1.986 . . . . 0.0 112.141 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.421 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 39.0 Cg_endo -67.41 -42.14 7.82 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.914 3.076 . . . . 0.0 111.016 176.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.57 -51.38 63.05 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -172.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -45.62 -48.13 14.7 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.873 0.869 . . . . 0.0 111.194 168.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.7 -52.59 63.69 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 -175.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -64.38 -32.99 74.82 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.132 0.973 . . . . 0.0 112.321 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -62.42 -52.06 65.05 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 119.887 1.221 . . . . 0.0 108.29 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -66.55 -37.44 84.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 117.972 -1.013 . . . . 0.0 111.875 -176.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 31.5 mm -59.19 -51.04 77.26 Favored 'Isoleucine or valine' 0 C--N 1.342 0.26 0 CA-C-N 119.777 1.171 . . . . 0.0 109.441 172.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.38 -38.14 79.74 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.992 0.815 . . . . 0.0 111.068 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.07 -8.3 55.12 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.299 1.04 . . . . 0.0 113.134 176.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 48.05 37.47 7.89 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.62 1.568 . . . . 0.0 112.016 -166.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.5 -6.66 21.56 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.456 1.502 . . . . 0.0 112.288 -177.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.26 128.85 35.88 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -173.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.6 t -114.31 156.49 15.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 174.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -123.31 145.25 48.87 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 127.423 2.289 . . . . 0.0 106.777 176.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -158.01 175.11 35.3 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 121.76 0.644 . . . . 0.0 113.451 -178.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mm -123.02 135.92 61.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.599 0 CA-C-O 124.808 2.242 . . . . 0.0 107.423 177.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.599 HG12 HG11 ' A' ' 61' ' ' VAL . 0.8 OUTLIER -68.03 -59.18 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.809 0 C-N-CA 131.282 3.833 . . . . 0.0 109.817 -177.346 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 56.52 165.23 0.07 OUTLIER Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 127.681 2.392 . . . . 0.0 113.34 -170.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.25 80.54 1.01 Allowed 'Trans proline' 0 N--CA 1.448 -1.182 0 N-CA-C 107.528 -1.758 . . . . 0.0 107.528 155.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.5 t -159.1 -72.72 0.08 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.309 -1.738 . . . . 0.0 106.309 162.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.89 160.84 7.18 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 123.525 0.73 . . . . 0.0 112.611 -164.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 m -66.42 112.03 3.85 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 172.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.599 HG11 HG12 ' A' ' 55' ' ' VAL . 8.5 m -140.0 160.58 59.89 Favored Pre-proline 0 C--O 1.238 0.488 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 178.054 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.28 168.02 18.84 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.37 2.047 . . . . 0.0 110.794 171.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.11 132.86 49.48 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 171.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 99.7 37.32 3.99 Favored Glycine 0 CA--C 1.492 -1.395 0 CA-C-O 118.399 -1.223 . . . . 0.0 114.198 170.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.873 HG23 ' HB2' ' A' ' 68' ' ' TYR 0.296 1.6 p -174.1 56.17 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 CA-C-O 123.018 1.39 . . . . 0.0 107.701 -168.175 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -86.76 -4.52 59.19 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.732 1.613 . . . . 0.0 112.011 177.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -164.51 20.48 0.06 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.031 2.132 . . . . 0.0 110.719 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.873 ' HB2' HG23 ' A' ' 65' ' ' VAL . 4.5 m-85 -83.69 100.18 10.71 Favored 'General case' 0 CA--C 1.52 -0.185 0 C-N-CA 126.128 1.771 . . . . 0.0 109.241 174.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -44.2 139.96 2.36 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 127.096 2.158 . . . . 0.0 111.86 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.408 ' HD2' HG13 ' A' ' 55' ' ' VAL . 47.0 p90 -127.12 166.93 16.72 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.485 1.114 . . . . 0.0 112.731 -175.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 19.1 mt -139.16 124.9 19.59 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 127.387 2.275 . . . . 0.0 106.347 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -150.59 143.47 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 126.138 1.775 . . . . 0.0 106.463 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.1 156.15 34.11 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 169.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.95 -24.32 62.44 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -174.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -111.46 3.73 18.33 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.434 1.894 . . . . 0.0 110.952 -174.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -101.27 19.82 16.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.203 1.801 . . . . 0.0 111.23 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -44.97 -43.34 8.99 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 126.532 1.933 . . . . 0.0 113.693 -169.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -124.99 13.78 8.46 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.662 1.185 . . . . 0.0 111.479 170.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.67 -68.65 1.52 Allowed Glycine 0 CA--C 1.522 0.518 0 C-N-CA 126.215 1.864 . . . . 0.0 110.209 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.4 m -148.91 156.98 43.08 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.861 0.864 . . . . 0.0 108.805 179.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.5 tt -155.88 159.79 2.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 172.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.595 HG23 ' HB3' ' A' ' 95' ' ' TYR . 9.7 mt -134.93 157.04 40.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 166.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.462 ' CD2' HG21 ' A' ' 65' ' ' VAL . 81.1 m-85 -133.13 155.97 48.29 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.122 2.569 . . . . 0.0 107.624 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -164.79 160.45 19.62 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.472 -1.393 . . . . 0.0 109.29 175.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.473 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -149.11 127.45 12.19 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 169.78 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.56 117.67 19.96 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 164.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -100.28 22.28 11.77 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.58 1.552 . . . . 0.0 109.703 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 86.58 121.09 1.3 Allowed Glycine 0 C--N 1.34 0.78 0 C-N-CA 125.324 1.44 . . . . 0.0 110.417 -177.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 50.82 1.01 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.656 2.382 . . . . 0.0 116.385 -171.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -151.5 145.27 25.06 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 126.028 1.731 . . . . 0.0 107.112 -162.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 68.0 t -138.4 108.63 4.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 125.119 1.368 . . . . 0.0 108.075 -175.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.415 HD12 ' H ' ' A' ' 92' ' ' ILE . 4.5 mp -77.88 104.62 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 162.243 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 34.2 mt -76.98 135.15 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 106.212 -1.773 . . . . 0.0 106.212 165.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -126.74 103.07 7.34 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.628 1.571 . . . . 0.0 109.825 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.595 ' HB3' HG23 ' A' ' 82' ' ' ILE . 40.6 p90 -119.72 165.56 14.36 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.067 -1.646 . . . . 0.0 111.322 -174.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.6 t -156.9 169.97 23.56 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.588 1.555 . . . . 0.0 108.019 171.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 m -109.86 -9.05 14.81 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.19 1.396 . . . . 0.0 111.114 172.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -136.0 112.82 10.22 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.5 1.52 . . . . 0.0 108.586 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -48.44 -32.89 8.38 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 126.188 1.795 . . . . 0.0 112.583 175.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . 0.296 0.0 OUTLIER -79.29 3.77 17.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.132 1.901 . . . . 0.0 116.132 178.051 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.2 p -120.3 165.75 14.44 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 119.078 0.854 . . . . 0.0 111.168 -178.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -66.26 158.01 30.07 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.341 0.591 . . . . 0.0 110.247 -174.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 61.2 mt -91.38 142.7 27.4 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.475 0.71 . . . . 0.0 109.457 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.08 173.08 0.87 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.348 0.659 . . . . 0.0 109.533 164.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.62 112.66 9.09 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.549 1.14 . . . . 0.0 108.199 170.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.2 tptt -123.03 97.69 5.55 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 105.314 -2.106 . . . . 0.0 105.314 178.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.94 126.57 35.45 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 178.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -123.3 157.94 32.09 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.895 1.278 . . . . 0.0 108.179 174.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.3 158.87 33.24 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.346 -0.846 . . . . 0.0 110.145 162.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 17.2 mt -47.13 -54.49 10.41 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.168 0.987 . . . . 0.0 109.665 162.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.27 -30.84 70.71 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 117.138 -1.41 . . . . 0.0 112.116 -174.013 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -62.79 -57.83 9.55 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 120.073 1.306 . . . . 0.0 109.867 173.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 92.8 mt -55.64 -32.14 62.92 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.463 0.574 . . . . 0.0 111.376 -178.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.8 tttm -70.64 -47.03 62.11 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 118.677 -0.678 . . . . 0.0 111.635 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -50.83 71.83 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 119.155 0.889 . . . . 0.0 108.773 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -57.36 -62.38 1.81 Allowed 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 124.882 1.273 . . . . 0.0 109.025 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.438 ' HE2' ' HB2' ' A' ' 35' ' ' ALA . 19.2 m-85 -127.99 13.38 6.77 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -157.429 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -143.77 58.03 1.36 Allowed 'General case' 0 C--O 1.24 0.586 0 O-C-N 119.792 -1.818 . . . . 0.0 109.901 173.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -108.47 -34.69 6.69 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.825 -168.39 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.2 t -107.55 148.05 29.75 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 125.297 1.439 . . . . 0.0 110.294 -173.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -60.82 -28.97 69.2 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.684 -1.26 . . . . 0.0 110.756 175.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.97 -39.22 74.18 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 119.589 1.086 . . . . 0.0 111.243 176.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.95 -18.52 60.64 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 179.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -78.32 -2.46 38.2 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.659 178.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.87 -79.71 0.2 Allowed 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 153.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -52.11 -61.88 1.99 Allowed 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -160.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 76.0 t -55.8 -36.94 45.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 118.534 0.606 . . . . 0.0 110.559 -176.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -77.34 -30.22 53.85 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.999 1.32 . . . . 0.0 111.896 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.41 -49.76 74.2 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 126.009 1.724 . . . . 0.0 109.394 164.536 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -59.25 -38.77 80.88 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.769 0.713 . . . . 0.0 110.543 -176.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 90.1 t -64.3 -33.26 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 118.983 0.811 . . . . 0.0 111.08 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -86.38 -23.35 26.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 118.86 0.755 . . . . 0.0 112.53 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.88 -32.19 13.4 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 125.003 1.287 . . . . 0.0 111.825 -176.505 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.3 pp -56.5 125.5 22.35 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 166.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -79.73 167.37 20.72 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 9.9 m -134.43 6.64 3.55 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 120.353 -1.467 . . . . 0.0 111.398 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.921 0 C-N-CA 127.719 2.408 . . . . 0.0 104.774 163.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.924 0 N-CA-C 111.54 -0.624 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -78.42 -43.91 26.14 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 159.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 17.0 ptm -111.47 175.75 5.3 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 127.16 2.184 . . . . 0.0 109.208 166.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 78.4 mttt -139.08 -166.05 1.96 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.407 1.883 . . . . 0.0 108.135 176.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.442 ' CZ ' ' HE3' ' A' ' 114' ' ' LYS . 4.5 m-85 54.42 -172.8 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.045 1.338 . . . . 0.0 110.983 -173.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.3 p -138.53 150.26 46.19 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.787 2.035 . . . . 0.0 107.326 171.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -59.4 -41.72 90.1 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.423 0.556 . . . . 0.0 110.106 -174.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -44.44 -56.04 4.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.385 1.874 . . . . 0.0 111.433 169.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -69.43 -30.86 68.89 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.904 1.282 . . . . 0.0 112.605 -174.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.491 HG21 ' HB2' ' A' ' 86' ' ' ALA . 48.2 mt -80.2 -34.96 15.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 C-N-CA 123.22 0.608 . . . . 0.0 109.821 -179.024 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.403 ' CA ' ' CZ ' ' A' ' 84' ' ' PHE . . . -55.73 -44.97 86.69 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 124.048 0.832 . . . . 0.0 112.055 -173.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.6 t -56.02 -50.49 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 118.306 1.053 . . . . 0.0 109.321 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 53.4 mt -58.26 -39.31 78.87 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.334 0.97 . . . . 0.0 110.832 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.13 -47.35 80.27 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 118.879 -0.581 . . . . 0.0 111.816 176.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.71 -29.27 72.73 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.976 0.807 . . . . 0.0 111.378 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.8 mt -62.08 -28.31 69.52 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 120.356 -1.673 . . . . 0.0 110.62 172.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.26 -12.99 59.95 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 117.111 -1.423 . . . . 0.0 113.094 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.0 mm -143.64 98.95 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 125.799 1.64 . . . . 0.0 107.309 -173.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t 56.71 68.65 2.06 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 124.836 1.254 . . . . 0.0 112.083 -175.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.32 -37.87 69.44 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.328 2.018 . . . . 0.0 110.711 176.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -47.01 77.74 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 118.185 -0.912 . . . . 0.0 112.078 -173.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 59.4 t90 -52.93 -52.94 56.13 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tt -58.15 -52.0 67.38 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 121.454 -0.779 . . . . 0.0 110.929 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -57.83 -35.17 70.51 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 118.574 -0.727 . . . . 0.0 111.123 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -69.66 -50.7 41.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 178.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -59.19 -38.41 79.76 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.354 -0.831 . . . . 0.0 112.305 -177.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 31.4 mm -60.53 -53.19 52.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 119.319 0.963 . . . . 0.0 109.36 173.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.65 -41.2 81.0 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 117.836 0.289 . . . . 0.0 110.749 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.53 -17.66 63.6 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.505 1.522 . . . . 0.0 113.141 176.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.1 t30 59.02 30.05 19.77 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.641 1.577 . . . . 0.0 110.838 -169.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -94.22 -16.65 23.46 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.879 1.272 . . . . 0.0 112.703 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.57 135.7 35.57 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.439 1.496 . . . . 0.0 109.59 -169.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 45.8 t -122.15 145.69 28.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 124.759 1.224 . . . . 0.0 108.004 170.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -106.31 136.22 46.42 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 128.049 2.54 . . . . 0.0 106.683 173.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -153.36 178.65 30.27 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-O 122.9 1.278 . . . . 0.0 113.697 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 26.8 mm -130.49 137.82 55.27 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.932 0 C-N-CA 127.981 2.512 . . . . 0.0 108.14 -171.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.605 HG12 HG11 ' A' ' 61' ' ' VAL 0.255 2.8 m -70.59 -75.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.409 -2.503 0 CA-C-N 108.823 -3.808 . . . . 0.0 108.675 179.398 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp 55.39 167.39 0.05 OUTLIER Pre-proline 0 C--N 1.349 0.543 0 C-N-CA 125.301 1.44 . . . . 0.0 111.573 -173.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -66.84 73.18 0.44 Allowed 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 121.719 1.613 . . . . 0.0 110.375 164.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.3 t -153.16 -63.67 0.15 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.826 1.25 . . . . 0.0 112.65 175.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.68 175.73 9.08 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 120.566 1.53 . . . . 0.0 110.935 -172.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 t -93.69 121.15 34.83 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 -179.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.605 HG11 HG12 ' A' ' 55' ' ' VAL . 4.8 m -150.42 160.8 32.28 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 123.957 0.903 . . . . 0.0 109.011 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -71.5 158.92 52.79 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.937 1.758 . . . . 0.0 111.092 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.19 129.55 40.62 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 173.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.64 22.99 9.72 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 117.461 -1.744 . . . . 0.0 114.824 174.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.2 m -141.2 70.01 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.8 1.8 . . . . 0.0 110.1 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -85.3 -11.49 54.58 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.923 1.689 . . . . 0.0 114.61 -172.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -170.44 25.68 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 126.266 1.826 . . . . 0.0 109.506 -166.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.431 ' CD1' ' HB2' ' A' ' 85' ' ' LYS . 3.5 m-85 -94.98 105.75 17.69 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.687 1.595 . . . . 0.0 107.426 176.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.08 150.11 4.66 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 118.99 0.813 . . . . 0.0 110.69 172.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -130.73 158.46 40.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.174 0.59 . . . . 0.0 111.03 -176.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -120.63 128.48 53.05 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 127.096 2.158 . . . . 0.0 106.98 174.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -153.22 159.62 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 173.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.419 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -89.78 161.45 16.02 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.371 0.605 . . . . 0.0 110.407 176.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.8 -5.59 4.5 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.106 0.962 . . . . 0.0 113.52 172.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -140.3 22.63 2.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.659 0.784 . . . . 0.0 110.972 -175.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.419 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 19.7 m-20 -127.0 29.18 5.66 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.407 1.883 . . . . 0.0 109.407 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -63.61 -5.33 3.81 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 119.252 -2.155 . . . . 0.0 114.33 -177.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -143.19 22.49 1.88 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.093 1.357 . . . . 0.0 111.511 160.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.12 -71.83 1.31 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 125.634 1.587 . . . . 0.0 111.198 -176.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 21.4 m -145.29 160.78 40.99 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.206 1.802 . . . . 0.0 107.572 177.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tt -152.4 155.04 7.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 168.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 16.2 mt -130.76 140.52 48.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 166.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -114.83 146.82 40.64 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.326 1.85 . . . . 0.0 109.2 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PHE . . . . . 0.403 ' CZ ' ' CA ' ' A' ' 29' ' ' GLY . 45.1 p90 -151.59 156.74 41.07 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.126 -0.984 . . . . 0.0 110.92 172.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.431 ' HB2' ' CD1' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -148.57 90.29 1.77 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.859 2.064 . . . . 0.0 110.248 178.836 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.491 ' HB2' HG21 ' A' ' 28' ' ' ILE . . . -72.36 104.42 3.74 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 119.287 -0.965 . . . . 0.0 109.006 172.301 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.14 128.83 55.34 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 125.666 1.586 . . . . 0.0 108.265 174.054 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 57.19 -89.23 0.01 OUTLIER Glycine 0 CA--C 1.528 0.875 0 C-N-CA 125.035 1.302 . . . . 0.0 111.735 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.486 ' HA ' HD12 ' A' ' 110' ' ' LEU . 17.6 mp0 -137.85 17.21 2.86 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.421 2.688 . . . . 0.0 112.024 -174.111 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 88.6 m -137.29 142.3 41.93 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.981 1.712 . . . . 0.0 110.154 -172.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.8 t -128.36 100.72 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 126.566 1.947 . . . . 0.0 107.04 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.633 HD12 ' H ' ' A' ' 92' ' ' ILE . 3.3 mp -72.44 77.62 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 130.091 3.357 . . . . 0.0 109.198 165.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mt -65.14 129.85 29.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 173.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -128.47 121.3 28.61 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.533 1.133 . . . . 0.0 108.073 -176.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -145.21 169.54 18.01 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 121.122 -0.986 . . . . 0.0 110.72 -168.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.5 t -157.01 174.45 15.5 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.623 0.725 . . . . 0.0 111.29 -171.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.2 p -106.58 -8.99 16.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.615 1.166 . . . . 0.0 112.056 165.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -144.42 147.57 33.53 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.68 0.792 . . . . 0.0 111.827 -175.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.9 ttt-85 -81.57 10.94 5.13 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.582 1.153 . . . . 0.0 112.088 173.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -116.86 3.74 12.91 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.418 1.487 . . . . 0.0 114.039 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 34.4 p -130.27 176.1 8.39 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.75 0.82 . . . . 0.0 112.702 -166.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.73 148.56 44.55 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.027 1.331 . . . . 0.0 109.061 172.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 84.9 mt -86.42 142.12 28.65 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 126.434 1.894 . . . . 0.0 108.872 175.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -64.37 168.81 5.28 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.276 1.03 . . . . 0.0 109.841 167.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -129.43 103.72 7.07 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.274 1.43 . . . . 0.0 109.55 -179.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.1 tptt -122.29 92.16 3.66 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -82.01 120.25 25.02 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 171.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.12 145.49 45.91 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 126.737 2.015 . . . . 0.0 106.674 168.061 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 2.4 p -67.37 157.59 33.69 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 121.536 -0.727 . . . . 0.0 111.207 173.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 89' ' ' GLN . 13.1 mt -51.87 -46.04 64.33 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 121.823 -0.548 . . . . 0.0 110.493 166.041 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.26 -41.01 98.99 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 117.194 -1.384 . . . . 0.0 111.081 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -62.39 1.64 Allowed 'General case' 0 C--N 1.345 0.41 0 CA-C-N 119.402 1.001 . . . . 0.0 109.382 174.244 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 56.7 mt -60.97 -38.27 85.35 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -174.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.442 ' HE3' ' CZ ' ' A' ' 23' ' ' PHE . 1.9 ttmp? -62.99 -43.1 99.72 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 118.849 -0.596 . . . . 0.0 109.77 176.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -56.38 13.94 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.491 1.041 . . . . 0.0 108.354 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -51.69 -42.12 61.94 Favored 'General case' 0 C--O 1.23 0.075 0 C-N-CA 124.929 1.292 . . . . 0.0 111.899 -174.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -132.01 20.39 4.52 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.8 0.44 . . . . 0.0 112.135 -165.351 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -161.99 61.43 0.24 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 122.125 0.964 . . . . 0.0 111.082 176.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.27 -47.85 4.19 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.016 0.926 . . . . 0.0 111.697 179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 80.8 p -88.5 161.49 16.96 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 121.246 -0.909 . . . . 0.0 110.137 179.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -83.06 -32.2 26.94 Favored 'General case' 0 C--N 1.334 -0.104 0 O-C-N 121.807 -0.558 . . . . 0.0 110.599 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.88 -37.09 80.98 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.981 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -65.92 -29.16 69.53 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.972 1.26 . . . . 0.0 111.793 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -56.38 -34.34 66.58 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 118.741 -0.647 . . . . 0.0 112.328 -172.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.56 -71.14 0.08 Allowed 'General case' 0 C--O 1.215 -0.739 0 C-N-CA 125.566 1.546 . . . . 0.0 108.155 174.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -47.9 -57.81 5.21 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 124.165 0.986 . . . . 0.0 112.585 178.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 92.3 t -55.95 -41.92 69.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.636 -174.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -77.76 -28.68 50.71 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.787 0.721 . . . . 0.0 112.091 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -58.91 -44.65 91.32 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 169.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -58.75 -28.48 65.92 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.225 0.61 . . . . 0.0 111.05 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.71 -14.22 18.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 123.609 0.764 . . . . 0.0 111.628 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -123.0 -12.36 7.98 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 120.174 1.352 . . . . 0.0 112.858 178.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -79.89 -21.08 66.59 Favored Glycine 0 CA--C 1.525 0.665 0 O-C-N 121.466 -0.771 . . . . 0.0 111.269 168.236 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.4 pp -68.52 141.04 55.65 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.369 1.085 . . . . 0.0 108.118 162.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -88.69 170.26 10.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 169.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 8.5 m -130.92 9.26 4.89 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.821 -1.175 . . . . 0.0 110.215 172.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 C--O 1.236 0.375 0 C-N-CA 128.24 2.616 . . . . 0.0 104.48 172.791 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.721 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -67.61 -17.86 64.77 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.277 1.031 . . . . 0.0 113.739 -177.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.16 63.19 2.37 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.677 1.191 . . . . 0.0 111.777 -171.373 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -123.27 166.91 14.47 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 127.494 2.318 . . . . 0.0 107.025 171.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -68.52 171.86 6.93 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 122.375 1.083 . . . . 0.0 109.255 165.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -137.17 155.97 48.91 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 126.929 2.092 . . . . 0.0 107.243 -170.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -49.68 -49.22 48.39 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.444 1.098 . . . . 0.0 110.722 175.218 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -44.82 -56.9 4.1 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.319 1.448 . . . . 0.0 112.332 172.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -70.92 -39.24 72.82 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.276 1.03 . . . . 0.0 110.602 -171.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 79.2 mt -64.86 -31.72 55.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.247 1.019 . . . . 0.0 109.237 175.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -49.44 -55.22 13.68 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 125.759 1.647 . . . . 0.0 111.843 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.0 t -68.31 -39.39 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 119.026 -0.512 . . . . 0.0 109.64 -173.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.9 mp -62.0 -52.74 62.78 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.908 0.776 . . . . 0.0 111.034 177.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.19 -31.43 72.57 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.574 0.625 . . . . 0.0 111.049 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.5 -27.24 70.56 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 118.637 0.653 . . . . 0.0 112.988 172.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.25 -27.45 60.77 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.977 1.889 . . . . 0.0 112.098 177.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.8 -25.92 64.93 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.891 170.305 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.1 mm -130.86 87.44 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 124.601 1.16 . . . . 0.0 108.68 -166.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.96 60.29 0.62 Allowed Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.009 1.324 . . . . 0.0 111.552 172.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -57.94 -37.52 95.79 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 123.236 2.624 . . . . 0.0 111.601 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -60.07 -41.66 92.89 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.376 0.67 . . . . 0.0 111.434 -178.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 37.1 t90 -61.16 -57.64 11.64 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 tt -50.25 -48.26 54.81 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.529 0.732 . . . . 0.0 110.337 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -63.95 -45.4 89.35 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.836 0.854 . . . . 0.0 111.376 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 77.2 mt-30 -59.89 -40.41 88.63 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.93 0.786 . . . . 0.0 111.208 173.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -63.68 -54.34 37.05 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -178.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 30.0 mm -55.49 -41.72 64.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.407 1.083 . . . . 0.0 109.691 178.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.84 7.21 1.64 Allowed 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.35 21.71 2.96 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.364 -0.835 . . . . 0.0 110.731 159.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.2 t30 50.95 25.0 2.02 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.373 2.269 . . . . 0.0 112.96 -175.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -81.24 -15.23 56.22 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 119.909 -1.744 . . . . 0.0 112.721 -174.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 tp -69.45 133.64 47.98 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 119.459 1.027 . . . . 0.0 109.044 -175.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.8 t -112.91 154.79 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 106.257 -1.757 . . . . 0.0 106.257 169.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -123.0 145.97 48.04 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 128.394 2.678 . . . . 0.0 107.209 173.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -162.86 171.13 38.58 Favored Glycine 0 C--N 1.332 0.348 0 O-C-N 121.166 -0.959 . . . . 0.0 113.687 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 31.4 mm -114.98 133.38 61.33 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.595 0 C-N-CA 126.804 2.042 . . . . 0.0 106.417 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.534 ' HA ' HG11 ' A' ' 61' ' ' VAL . 0.5 OUTLIER -44.5 -54.21 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.589 1 C-N-CA 133.237 4.615 . . . . 0.0 112.266 169.271 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 19.8 mttt 62.89 159.65 0.12 Allowed Pre-proline 0 CA--C 1.536 0.421 0 C-N-CA 126.666 1.987 . . . . 0.0 112.971 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -70.75 -12.28 30.79 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.324 2.682 . . . . 0.0 113.278 -178.027 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 47.8 m -149.55 90.69 1.74 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.366 1.466 . . . . 0.0 107.795 170.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -138.92 -165.16 1.78 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 156.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.7 t -92.71 36.76 1.01 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.336 1.454 . . . . 0.0 112.585 -170.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.534 HG11 ' HA ' ' A' ' 55' ' ' VAL . 9.5 m -105.73 153.24 40.1 Favored Pre-proline 0 C--N 1.324 -0.539 0 C-N-CA 123.43 0.692 . . . . 0.0 109.252 -167.229 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.99 178.04 4.47 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.998 2.465 . . . . 0.0 111.311 -174.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.92 160.04 24.8 Favored 'General case' 0 C--O 1.238 0.482 0 O-C-N 121.185 -0.947 . . . . 0.0 109.35 170.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.9 33.74 65.81 Favored Glycine 0 CA--C 1.529 0.967 0 CA-C-O 119.615 -0.547 . . . . 0.0 112.117 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.2 m -146.34 25.38 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 125.923 1.689 . . . . 0.0 110.398 176.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.47 -5.14 0.3 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 127.778 2.431 . . . . 0.0 116.674 -164.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -157.57 15.98 0.25 Allowed 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 127.187 2.195 . . . . 0.0 109.883 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.491 ' CE2' ' HE3' ' A' ' 94' ' ' LYS . 5.6 m-85 -86.98 100.83 12.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.23 148.6 8.24 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.685 0.675 . . . . 0.0 110.076 174.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 46.6 p90 -123.38 166.78 14.76 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.422 1.089 . . . . 0.0 111.244 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 31.2 mt -136.27 130.46 33.03 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 127.564 2.346 . . . . 0.0 105.282 176.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.1 p -148.96 151.77 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 176.288 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -86.49 143.89 27.52 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.56 1.073 . . . . 0.0 109.003 176.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.19 -10.26 4.3 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 128.246 2.618 . . . . 0.0 114.604 -171.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.83 7.05 4.37 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.804 1.241 . . . . 0.0 111.609 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -134.58 31.82 3.37 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.188 1.795 . . . . 0.0 107.215 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -67.87 -18.69 64.89 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.449 1.5 . . . . 0.0 113.116 -166.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.75 20.66 12.24 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.59 1.956 . . . . 0.0 109.471 174.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.2 -98.36 2.56 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 126.535 2.017 . . . . 0.0 109.478 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.4 m -74.58 162.28 28.92 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.603 1.161 . . . . 0.0 108.57 169.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.9 tt -161.42 154.83 3.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 O-C-N 121.005 -1.059 . . . . 0.0 108.741 153.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.54 HG23 ' HB3' ' A' ' 95' ' ' TYR . 3.6 mt -138.34 147.77 25.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 175.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -133.39 156.66 47.26 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 127.894 2.477 . . . . 0.0 108.567 -174.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -162.7 159.61 24.54 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.408 -1.432 . . . . 0.0 111.174 174.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.52 115.88 6.2 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.94 1.296 . . . . 0.0 109.875 176.3 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.544 ' HA ' HG22 ' A' ' 91' ' ' VAL . . . -70.26 96.84 1.15 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.712 0.805 . . . . 0.0 109.482 167.173 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -64.18 -17.23 63.32 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.867 -0.587 . . . . 0.0 111.052 163.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 100.78 122.61 4.99 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 108.409 -1.876 . . . . 0.0 108.409 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 60.35 -7.14 0.08 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.067 1.747 . . . . 0.0 113.614 -161.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.07 146.29 36.96 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 128.148 2.579 . . . . 0.0 107.861 178.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.544 HG22 ' HA ' ' A' ' 86' ' ' ALA . 41.2 t -132.82 114.32 21.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 172.578 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.421 ' N ' HD12 ' A' ' 92' ' ' ILE . 2.8 mp -79.71 105.25 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 N-CA-C 104.544 -2.391 . . . . 0.0 104.544 171.455 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 2.9 mt -77.32 142.09 14.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 106.359 -1.719 . . . . 0.0 106.359 169.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.491 ' HE3' ' CE2' ' A' ' 68' ' ' TYR . 88.6 mttt -132.13 123.52 27.28 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.904 1.281 . . . . 0.0 108.615 171.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.54 ' HB3' HG23 ' A' ' 82' ' ' ILE . 43.7 p90 -142.22 166.76 23.81 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.901 -1.124 . . . . 0.0 111.126 -176.037 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.4 t -154.19 175.83 13.0 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 124.523 1.129 . . . . 0.0 109.259 -172.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 93.2 p -119.78 3.84 11.06 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.273 1.029 . . . . 0.0 111.811 166.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -137.85 141.64 40.75 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 157.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -50.7 -42.47 57.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.56 1.144 . . . . 0.0 109.972 174.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -95.04 24.82 4.57 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 129.066 2.946 . . . . 0.0 113.454 -173.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 67.7 p -126.74 159.12 34.66 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.793 1.633 . . . . 0.0 109.359 170.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -64.87 130.26 42.79 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 121.372 -0.83 . . . . 0.0 110.019 -174.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.45 152.38 34.52 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.243 1.817 . . . . 0.0 110.815 177.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -73.75 174.88 7.79 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.919 1.688 . . . . 0.0 109.804 168.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -119.24 132.33 55.91 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.049 1.339 . . . . 0.0 109.145 168.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.01 130.41 17.71 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 167.706 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -140.53 92.16 2.49 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 119.829 1.195 . . . . 0.0 109.586 -167.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.05 166.45 11.23 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.045 0.938 . . . . 0.0 109.203 -174.294 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 42.0 p -84.93 161.99 19.61 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 123.088 0.555 . . . . 0.0 112.043 177.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.8 mt -57.78 -40.1 79.02 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 174.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.45 -37.0 82.3 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 116.238 -1.839 . . . . 0.0 111.554 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.28 -63.83 1.0 Allowed 'General case' 0 C--N 1.347 0.496 0 CA-C-N 121.64 2.018 . . . . 0.0 110.746 169.279 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 29.2 mt -55.84 -34.36 65.34 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.214 0.531 . . . . 0.0 110.893 -175.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -71.17 -40.4 71.31 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.148 0.579 . . . . 0.0 111.174 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.77 -14.64 61.58 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 124.646 1.178 . . . . 0.0 112.236 176.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -101.08 -41.76 6.64 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 123.456 0.703 . . . . 0.0 110.227 -173.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -130.98 -0.5 4.17 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -168.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.476 ' C ' HE22 ' A' ' 123' ' ' GLN . 4.4 t80 -136.11 54.77 1.88 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 122.912 1.339 . . . . 0.0 110.617 -176.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -88.25 -59.04 2.35 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 127.561 2.344 . . . . 0.0 114.728 174.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.9 p -77.57 -166.96 0.84 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.882 1.673 . . . . 0.0 111.886 -164.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.24 -51.16 3.01 Favored 'General case' 0 CA--C 1.522 -0.103 0 C-N-CA 124.701 1.201 . . . . 0.0 108.604 -178.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.6 t -57.65 -30.44 65.41 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.262 1.825 . . . . 0.0 112.041 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.476 HE22 ' C ' ' A' ' 118' ' ' TYR . 10.5 pt20 -53.68 -32.4 51.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.668 1.576 . . . . 0.0 111.559 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -68.37 0.42 3.92 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 125.108 1.363 . . . . 0.0 112.361 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -108.78 0.19 20.28 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.566 1.546 . . . . 0.0 111.325 175.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -121.4 -64.7 1.2 Allowed 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 125.538 1.535 . . . . 0.0 107.478 173.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 21.9 t -52.23 -47.31 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.468 1.507 . . . . 0.0 111.056 -178.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -67.94 -32.31 72.66 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.35 0.871 . . . . 0.0 113.35 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -75.97 -35.02 59.81 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 126.672 1.989 . . . . 0.0 110.594 -172.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -60.89 -33.96 73.92 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 127.678 2.391 . . . . 0.0 111.172 171.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 52.7 t -66.37 -22.24 29.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 O-C-N 121.317 -0.865 . . . . 0.0 110.689 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -98.04 -12.26 22.08 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.611 1.164 . . . . 0.0 112.413 171.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.6 12.1 66.35 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 125.402 1.477 . . . . 0.0 112.414 178.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.9 pp -119.28 177.27 4.96 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.886 1.674 . . . . 0.0 109.405 174.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -130.65 176.03 8.52 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 127.029 2.132 . . . . 0.0 108.754 -168.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -133.69 -0.67 3.15 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.368 0.985 . . . . 0.0 113.087 -175.491 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.252 1.197 0 C-N-CA 127.763 2.425 . . . . 0.0 107.104 -155.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.009 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.3 p80 45.19 28.04 0.38 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 128.448 2.699 . . . . 0.0 116.425 173.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.95 174.28 15.57 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.553 2.341 . . . . 0.0 106.143 170.195 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt 50.99 28.99 4.15 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.772 2.029 . . . . 0.0 115.564 168.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 61.19 172.48 0.11 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 128.718 2.807 . . . . 0.0 111.148 -170.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.2 p -110.96 149.64 30.38 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 120.953 -1.092 . . . . 0.0 109.458 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -54.71 -31.02 57.55 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.381 1.472 . . . . 0.0 111.335 -176.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -59.87 -60.1 4.37 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 129.369 3.067 . . . . 0.0 110.742 174.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -69.59 -36.44 76.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.623 1.569 . . . . 0.0 109.473 -172.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 82.9 mt -62.34 -39.49 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.648 0.779 . . . . 0.0 109.131 170.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.21 -55.13 25.87 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 124.747 1.165 . . . . 0.0 111.879 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 50.5 t -61.44 -41.88 91.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.311 1.055 . . . . 0.0 110.51 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.1 mt -62.14 -49.27 76.53 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 118.818 0.735 . . . . 0.0 111.055 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.53 93.2 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.429 0.292 . . . . 0.0 110.967 175.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.85 -32.91 85.75 Favored Glycine 0 C--O 1.222 -0.654 0 CA-C-O 119.07 -0.85 . . . . 0.0 111.634 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.533 HD12 HD21 ' A' ' 41' ' ' LEU . 7.2 mp -65.57 -30.48 71.22 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 120.342 2.071 . . . . 0.0 112.496 177.255 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.16 -26.17 68.41 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 118.916 -0.564 . . . . 0.0 111.384 175.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.403 HG21 ' HB3' ' A' ' 95' ' ' TYR . 44.6 mm -131.18 99.93 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 C-N-CA 126.208 1.803 . . . . 0.0 106.854 -165.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.278 1.5 p 57.24 56.32 7.77 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.808 174.086 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -59.14 -38.33 87.15 Favored 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 123.82 3.014 . . . . 0.0 110.185 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -63.14 -46.08 88.92 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 123.997 0.919 . . . . 0.0 110.906 -176.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -57.19 -46.1 83.13 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 172.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.533 HD21 HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -63.21 -50.35 70.63 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 106.463 -1.681 . . . . 0.0 106.463 -172.018 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -63.53 -40.33 96.76 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 125.372 1.469 . . . . 0.0 111.565 -178.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -57.06 -40.48 76.91 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.948 1.249 . . . . 0.0 110.603 175.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -81.03 -39.12 26.32 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 117.2 -1.381 . . . . 0.0 111.141 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 28.3 mm -57.45 -47.0 85.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 121.207 1.821 . . . . 0.0 108.73 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.69 -5.86 9.78 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -176.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.68 15.63 8.75 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.377 1.471 . . . . 0.0 112.495 173.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 66.44 6.7 4.5 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.043 1.737 . . . . 0.0 113.985 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.64 -13.67 56.07 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 120.446 -1.409 . . . . 0.0 112.235 -159.403 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.92 114.97 27.84 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.704 0.684 . . . . 0.0 110.728 -158.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 38.3 t -95.96 164.46 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 125.137 1.375 . . . . 0.0 108.601 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -143.49 138.28 29.11 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 128.977 2.911 . . . . 0.0 105.343 -176.42 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -157.68 177.58 34.4 Favored Glycine 0 C--N 1.333 0.407 0 CA-C-N 118.313 0.506 . . . . 0.0 112.346 173.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 15.7 mm -101.4 140.17 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.15 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 164.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.0 t -44.46 -64.54 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 C-N-CA 127.204 2.201 . . . . 0.0 111.469 176.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.4 mttt 57.57 165.53 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.065 1.746 . . . . 0.0 112.037 -170.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -76.69 -11.39 18.5 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 121.714 1.609 . . . . 0.0 112.832 176.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.3 m -97.12 23.93 6.85 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.423 1.489 . . . . 0.0 112.788 -163.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -139.94 -164.88 1.78 Allowed 'General case' 0 C--O 1.241 0.607 0 C-N-CA 127.176 2.191 . . . . 0.0 106.653 176.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 24.8 m -125.45 98.02 5.43 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 120.472 -1.392 . . . . 0.0 109.525 -166.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.2 m -137.57 157.73 73.21 Favored Pre-proline 0 C--O 1.241 0.645 0 C-N-CA 124.002 0.921 . . . . 0.0 113.054 -166.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.3 171.26 10.65 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.621 2.881 . . . . 0.0 110.602 171.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.32 158.19 34.43 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 121.594 -0.691 . . . . 0.0 111.735 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.49 31.32 63.26 Favored Glycine 0 CA--C 1.526 0.744 0 C-N-CA 124.009 0.814 . . . . 0.0 113.01 167.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.6 m -132.94 26.03 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 124.552 1.141 . . . . 0.0 110.317 174.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.97 -10.79 23.46 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 -154.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -151.39 31.76 0.59 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.863 2.065 . . . . 0.0 108.58 174.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -75.11 153.24 38.39 Favored 'General case' 0 C--O 1.232 0.151 0 O-C-N 120.919 -1.113 . . . . 0.0 108.49 173.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.2 m -72.83 154.48 40.6 Favored 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 123.712 0.805 . . . . 0.0 109.014 156.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -138.48 165.95 25.52 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.594 1.158 . . . . 0.0 109.823 167.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.3 mt -140.47 125.78 18.78 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 127.288 2.235 . . . . 0.0 105.504 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -148.23 150.94 13.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 174.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.66 159.26 17.21 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.784 0.802 . . . . 0.0 109.976 178.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.08 -18.03 63.94 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.199 1.0 . . . . 0.0 113.255 -168.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -102.97 -32.25 9.83 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 123.305 0.642 . . . . 0.0 111.536 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.97 9.65 0.52 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 129.038 2.935 . . . . 0.0 112.65 -176.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -56.41 -26.11 52.29 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.611 1.55 . . . . 0.0 113.618 -158.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.83 -5.88 19.43 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.695 1.589 . . . . 0.0 113.66 174.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.53 -93.64 0.88 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.852 1.215 . . . . 0.0 111.75 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.95 171.05 9.56 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.549 0.74 . . . . 0.0 110.133 -170.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tt -173.58 158.65 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 126.494 1.918 . . . . 0.0 106.944 162.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.425 HG23 ' HB3' ' A' ' 95' ' ' TYR . 22.8 mt -134.86 142.53 40.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 166.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -115.38 154.34 29.38 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.974 1.31 . . . . 0.0 108.541 174.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -158.65 148.1 19.19 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 125.349 1.459 . . . . 0.0 108.252 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -140.48 138.17 34.42 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 168.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -89.52 134.96 33.87 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 172.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -130.29 88.15 2.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 127.248 2.219 . . . . 0.0 108.658 174.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.69 -82.5 0.3 Allowed Glycine 0 C--N 1.336 0.541 0 C-N-CA 125.235 1.398 . . . . 0.0 113.078 170.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -123.79 9.93 8.91 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 126.815 2.046 . . . . 0.0 110.95 178.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.7 m -124.14 157.11 35.44 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.324 2.25 . . . . 0.0 108.51 -179.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 80.8 t -132.44 128.51 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.73 2.012 . . . . 0.0 105.882 168.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 20.1 mm -102.35 98.94 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 105.267 -2.123 . . . . 0.0 105.267 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.3 mt -83.44 130.67 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -134.53 91.26 2.76 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.879 1.672 . . . . 0.0 108.606 -175.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.425 ' HB3' HG23 ' A' ' 82' ' ' ILE . 31.0 p90 -108.48 170.36 8.07 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.807 -1.183 . . . . 0.0 111.645 -173.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.4 t -159.01 173.72 16.04 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.899 1.28 . . . . 0.0 110.152 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.9 m -121.7 12.9 10.72 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.08 2.552 . . . . 0.0 111.485 167.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -144.27 127.11 16.29 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 160.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -49.22 -39.34 29.52 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.593 0.757 . . . . 0.0 110.712 170.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -82.75 31.41 0.42 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.155 1.782 . . . . 0.0 113.628 -177.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 45.6 p -139.22 163.36 32.67 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 119.519 -1.988 . . . . 0.0 112.741 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.541 ' HE3' ' HA ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -58.44 153.92 14.87 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.611 1.164 . . . . 0.0 110.028 169.387 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -105.54 156.17 18.48 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.259 1.424 . . . . 0.0 110.789 -169.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.17 179.04 1.66 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.834 1.254 . . . . 0.0 112.0 173.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -123.07 124.9 44.14 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.707 1.203 . . . . 0.0 109.413 168.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -144.76 105.95 4.2 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 103.911 -2.625 . . . . 0.0 103.911 168.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -118.05 109.34 16.33 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -172.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 27.0 mt -125.14 144.56 50.37 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -166.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 15.9 p -68.52 151.7 46.41 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.952 0.796 . . . . 0.0 109.834 172.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 26.8 mt -55.72 -36.0 66.75 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.426 -0.796 . . . . 0.0 111.211 168.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.4 t -61.53 -44.52 96.9 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.021 173.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.83 -60.81 2.85 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.411 1.085 . . . . 0.0 109.891 178.436 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 48.0 mt -55.91 -33.52 64.74 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 123.07 0.548 . . . . 0.0 111.948 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 -43.9 77.28 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.665 -0.647 . . . . 0.0 109.29 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -25.21 61.46 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.665 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.72 -66.61 0.61 Allowed 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 169.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -117.22 22.98 12.15 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.851 -1.156 . . . . 0.0 112.763 -158.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -151.06 26.55 0.71 Allowed 'General case' 0 C--O 1.239 0.542 0 O-C-N 120.744 -1.223 . . . . 0.0 112.632 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.24 -59.62 3.27 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -172.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 17.9 p -77.81 172.03 14.07 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.016 1.327 . . . . 0.0 110.812 -171.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.83 -50.12 8.4 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 171.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -41.21 63.41 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.514 1.126 . . . . 0.0 110.92 -176.12 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -48.17 -45.57 33.67 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.734 1.214 . . . . 0.0 111.497 178.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -59.34 -20.37 54.1 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.795 1.638 . . . . 0.0 113.49 -169.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -55.0 -70.7 0.1 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 170.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -57.57 -41.97 82.14 Favored 'General case' 0 C--O 1.222 -0.373 0 O-C-N 123.769 0.668 . . . . 0.0 111.467 -174.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 17.7 t -54.21 -59.0 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 O-C-N 123.919 0.762 . . . . 0.0 109.794 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -57.47 -34.04 68.61 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 123.169 0.293 . . . . 0.0 111.238 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -64.52 -42.15 95.95 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.961 1.304 . . . . 0.0 110.958 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -58.78 -45.76 89.1 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.032 -1.043 . . . . 0.0 109.837 171.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 19.0 t -64.74 -31.1 52.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 O-C-N 121.844 -0.535 . . . . 0.0 110.89 179.1 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -84.84 -15.03 46.13 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.452 1.101 . . . . 0.0 113.181 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -96.94 -32.6 6.41 Favored Glycine 0 C--N 1.334 0.421 0 C-N-CA 124.123 0.868 . . . . 0.0 111.808 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.56 151.52 20.31 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.087 0.944 . . . . 0.0 112.177 -173.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 56.6 mtp85 -92.37 153.26 19.29 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 174.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 m -131.19 25.37 4.89 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.846 1.258 . . . . 0.0 109.635 173.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.917 2.887 . . . . 0.0 110.949 -164.141 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.642 0 CA-C-O 119.405 -0.664 . . . . 0.0 111.566 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -153.38 29.73 0.49 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.036 1.334 . . . . 0.0 111.286 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 3.1 ttt -101.74 66.45 1.06 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 167.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.8 pttp -140.93 37.1 1.77 Allowed 'General case' 0 N--CA 1.467 0.397 0 O-C-N 120.969 -1.082 . . . . 0.0 112.089 -172.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 55.76 -171.85 0.07 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.363 1.465 . . . . 0.0 110.433 -162.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -122.35 152.69 39.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.548 1.539 . . . . 0.0 109.534 -175.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.59 -55.62 5.03 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 125.707 1.603 . . . . 0.0 111.354 177.039 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -44.91 -63.21 0.97 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.651 1.58 . . . . 0.0 110.359 174.653 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.404 ' NE2' HG11 ' A' ' 131' ' ' VAL . 69.7 mm-40 -54.65 -59.64 4.43 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.108 0.963 . . . . 0.0 109.241 -176.234 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 35.8 mt -56.91 -34.63 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 125.438 1.495 . . . . 0.0 110.395 -170.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.56 -28.38 71.26 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 117.958 -1.468 . . . . 0.0 114.065 -178.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 72.4 t -71.95 -40.71 68.43 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.183 0 CA-C-N 119.027 1.414 . . . . 0.0 108.635 177.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.89 -43.8 97.83 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.218 0.607 . . . . 0.0 109.71 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.88 -43.58 95.61 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.081 -0.387 . . . . 0.0 110.931 174.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.39 -30.21 75.0 Favored Glycine 0 C--O 1.222 -0.604 0 N-CA-C 110.633 -0.987 . . . . 0.0 110.633 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.9 tp -69.33 -24.0 63.86 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 120.49 -1.594 . . . . 0.0 112.018 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.85 -21.46 62.42 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.849 -0.596 . . . . 0.0 111.793 170.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.441 HD12 ' CE2' ' A' ' 95' ' ' TYR . 28.7 mm -135.52 92.89 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 C-N-CA 126.261 1.824 . . . . 0.0 107.539 -158.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 74.7 m 60.2 54.91 4.05 Favored Pre-proline 0 CA--C 1.553 1.063 0 O-C-N 121.348 -0.845 . . . . 0.0 112.176 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -60.03 -38.15 79.88 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.968 3.112 . . . . 0.0 111.796 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -55.71 -52.65 63.15 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.699 1.199 . . . . 0.0 109.68 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -61.43 -38.26 86.52 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.684 1.194 . . . . 0.0 111.054 177.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -52.89 58.17 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -62.38 -43.16 99.48 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.866 0.866 . . . . 0.0 111.743 -175.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -61.25 -44.0 97.96 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 119.248 0.931 . . . . 0.0 110.045 -176.153 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -69.64 -35.89 75.6 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 117.289 -1.339 . . . . 0.0 112.422 -176.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.9 mm -56.5 -53.67 37.94 Favored 'Isoleucine or valine' 0 C--N 1.339 0.149 0 CA-C-N 119.215 0.916 . . . . 0.0 109.469 168.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.75 -21.7 66.06 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -177.124 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.95 -8.13 58.87 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 126.752 2.021 . . . . 0.0 113.663 169.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 44.89 43.55 7.15 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.238 2.215 . . . . 0.0 110.531 -169.516 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -103.53 -2.13 27.26 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.407 2.283 . . . . 0.0 115.06 -177.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.13 135.06 44.38 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.011 1.324 . . . . 0.0 110.664 -160.049 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 71.7 t -120.4 117.45 53.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 124.462 1.105 . . . . 0.0 108.041 -175.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.462 ' CD2' HG23 ' A' ' 136' ' ' THR . 23.3 t80 -80.76 152.64 28.21 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.604 1.562 . . . . 0.0 108.357 163.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -173.79 165.32 37.11 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 171.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 36.1 mm -104.06 141.7 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 170.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.57 HG13 HG11 ' A' ' 61' ' ' VAL . 24.1 t -44.23 -71.66 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 127.322 2.249 . . . . 0.0 114.43 -171.044 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.1 mptt 55.77 165.8 0.06 OUTLIER Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 125.281 1.432 . . . . 0.0 113.777 -169.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.64 -4.39 14.52 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.11 2.54 . . . . 0.0 113.86 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.32 -70.37 0.1 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.127 2.171 . . . . 0.0 112.388 -174.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.5 171.39 13.43 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.124 0.97 . . . . 0.0 109.042 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -66.04 142.03 57.95 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 165.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.57 HG11 HG13 ' A' ' 55' ' ' VAL . 0.3 OUTLIER -152.62 158.27 33.29 Favored Pre-proline 0 C--O 1.242 0.67 0 C-N-CA 123.658 0.783 . . . . 0.0 110.176 169.223 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.88 178.79 3.7 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 124.34 3.36 . . . . 0.0 111.197 166.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -76.2 167.78 21.24 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.346 -0.846 . . . . 0.0 111.391 178.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.44 18.72 77.18 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 118.603 -1.11 . . . . 0.0 114.402 165.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.2 m -130.24 21.88 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 118.764 1.282 . . . . 0.0 112.402 -174.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.74 -17.27 3.26 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 118.43 2.752 . . . . 0.0 118.43 -162.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -149.57 18.91 0.93 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 127.237 2.215 . . . . 0.0 109.195 -174.403 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.442 ' CD1' ' HG3' ' A' ' 85' ' ' LYS . 3.1 m-85 -69.7 148.86 48.69 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 171.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.0 t -67.23 161.56 24.59 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 155.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -141.99 141.92 32.91 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.814 161.217 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.1 133.75 52.88 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 172.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.7 p -156.79 149.96 10.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 174.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.25 170.32 15.8 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.709 1.14 . . . . 0.0 109.578 173.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.66 -29.98 63.89 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 122.134 0.968 . . . . 0.0 112.239 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -90.96 -37.61 13.38 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 127.51 2.324 . . . . 0.0 111.889 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . 0.279 0.0 OUTLIER -91.59 30.37 1.34 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.346 0.975 . . . . 0.0 111.859 -169.536 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -45.57 -53.98 8.27 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.51 1.124 . . . . 0.0 112.878 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -86.75 6.34 31.91 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.817 1.247 . . . . 0.0 112.537 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -92.17 -106.42 1.59 Allowed Glycine 0 CA--C 1.525 0.707 0 C-N-CA 126.68 2.086 . . . . 0.0 110.91 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 39.9 m -90.0 153.61 20.46 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.261 1.425 . . . . 0.0 108.893 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tt -153.62 146.25 14.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 O-C-N 120.14 -1.6 . . . . 0.0 108.777 162.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mt -128.39 113.05 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 178.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -90.77 143.43 26.73 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -148.6 160.18 43.36 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.983 -1.073 . . . . 0.0 111.612 170.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.442 ' HG3' ' CD1' ' A' ' 68' ' ' TYR . 1.3 tmtt? -148.91 129.37 13.9 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.073 0.949 . . . . 0.0 108.951 171.542 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . 0.424 ' HA ' HG22 ' A' ' 91' ' ' VAL . . . -104.82 115.27 30.02 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 124.053 0.941 . . . . 0.0 110.09 -174.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -126.41 99.24 5.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.403 2.281 . . . . 0.0 108.512 -165.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 67.21 -83.13 0.13 Allowed Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.747 1.165 . . . . 0.0 114.821 173.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -133.78 20.82 3.86 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.242 2.217 . . . . 0.0 110.752 176.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.2 146.63 45.12 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.376 1.87 . . . . 0.0 109.022 -174.184 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' VAL . . . . . 0.424 HG22 ' HA ' ' A' ' 86' ' ' ALA . 96.8 t -131.72 124.53 54.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 169.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.468 ' N ' HD12 ' A' ' 92' ' ' ILE . 2.8 mp -93.04 101.47 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 105.094 -2.187 . . . . 0.0 105.094 177.331 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.5 mt -92.67 121.13 43.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -121.13 96.05 4.94 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 126.742 2.017 . . . . 0.0 107.4 -175.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.441 ' CE2' HD12 ' A' ' 36' ' ' ILE . 34.5 p90 -113.45 168.26 9.9 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.386 -1.446 . . . . 0.0 111.421 -174.445 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.1 t -155.44 179.39 9.22 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.844 1.658 . . . . 0.0 107.195 177.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.2 p -122.19 2.4 9.79 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 127.056 2.143 . . . . 0.0 110.019 171.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -139.84 131.76 27.7 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-O 121.117 0.484 . . . . 0.0 111.363 164.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -3.26 3.8 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 128.486 2.715 . . . . 0.0 112.994 177.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -122.59 33.06 5.54 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.546 1.538 . . . . 0.0 110.264 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.4 p -130.43 -164.43 1.42 Allowed 'General case' 0 CA--C 1.546 0.809 0 O-C-N 120.686 -1.259 . . . . 0.0 112.695 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -100.58 154.28 18.7 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.231 1.413 . . . . 0.0 108.481 169.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -89.46 158.2 17.81 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.845 0.858 . . . . 0.0 110.354 -172.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -67.36 -178.91 0.92 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.443 1.097 . . . . 0.0 109.154 160.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -140.68 97.82 3.28 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -97.08 160.89 14.08 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 155.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -156.13 91.03 1.24 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.624 1.17 . . . . 0.0 107.857 169.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -96.34 163.45 13.07 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.611 0.764 . . . . 0.0 109.562 -178.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 40.9 p -81.46 163.01 23.05 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 166.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.37 -43.15 78.92 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 123.637 0.775 . . . . 0.0 109.007 169.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.79 -39.71 95.08 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.369 -0.824 . . . . 0.0 111.583 -176.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.8 -65.74 0.51 Allowed 'General case' 0 C--N 1.345 0.41 0 CA-C-O 118.537 -0.744 . . . . 0.0 109.321 168.302 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 93.9 mt -54.73 -30.74 57.03 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.221 1.009 . . . . 0.0 112.304 -174.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 59.7 tttt -66.31 -46.74 75.88 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 -7.69 58.83 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 124.609 1.163 . . . . 0.0 113.097 178.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -73.01 -66.13 0.71 Allowed 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 160.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -130.06 11.48 5.54 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 120.537 -1.352 . . . . 0.0 113.918 -154.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' TYR . . . . . 0.482 ' CZ ' ' HE2' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -140.65 22.48 2.32 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 120.796 -1.19 . . . . 0.0 111.622 179.324 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.77 -45.55 51.04 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 105.097 -2.186 . . . . 0.0 105.097 -163.19 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.8 t -91.52 150.83 21.02 Favored 'General case' 0 C--N 1.352 0.674 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -74.51 -20.34 60.01 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-O 117.327 -1.32 . . . . 0.0 112.257 177.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 4.2 t -81.24 -32.4 33.38 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 120.212 1.369 . . . . 0.0 110.932 -178.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -62.29 -26.77 68.59 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.981 1.264 . . . . 0.0 111.405 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.482 ' HE2' ' CZ ' ' A' ' 118' ' ' TYR . 2.6 mtpm? -47.87 -29.61 3.42 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 125.986 1.714 . . . . 0.0 113.463 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -52.67 -59.38 4.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.482 1.513 . . . . 0.0 110.26 175.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.73 -49.89 66.79 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 125.478 1.511 . . . . 0.0 110.013 -177.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 13.6 t -54.4 -54.85 18.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.405 -178.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -65.07 -25.62 67.88 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 178.217 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -65.41 -34.75 79.04 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.704 172.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -66.08 -34.82 78.94 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 119.963 1.256 . . . . 0.0 111.098 173.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.404 HG11 ' NE2' ' A' ' 27' ' ' GLN . 18.2 t -73.41 -12.01 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 O-C-N 121.558 -0.714 . . . . 0.0 111.136 177.633 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -121.34 22.14 10.88 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.491 1.517 . . . . 0.0 111.951 -176.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -132.86 -0.13 4.39 Favored Glycine 0 CA--C 1.528 0.9 0 O-C-N 120.876 -1.14 . . . . 0.0 112.684 174.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -76.26 -178.09 4.35 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 125.913 1.685 . . . . 0.0 111.632 173.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.1 mtt-85 -130.62 166.43 20.69 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 126.33 1.852 . . . . 0.0 107.013 164.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' THR . . . . . 0.462 HG23 ' CD2' ' A' ' 52' ' ' TYR . 2.3 m -122.73 -0.51 9.1 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 124.295 1.038 . . . . 0.0 111.013 177.199 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 C--O 1.246 0.884 0 CA-C-O 115.198 -2.334 . . . . 0.0 107.595 -149.151 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 . . . . . 0 CA--C 1.543 0.684 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 p -131.22 152.39 50.55 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.182 1.393 . . . . 0.0 107.29 168.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -59.33 -42.89 92.53 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 124.357 1.063 . . . . 0.0 109.769 -173.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -45.12 -47.64 12.12 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.019 1.728 . . . . 0.0 111.998 172.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -73.84 -28.71 61.74 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.685 1.194 . . . . 0.0 111.846 -174.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 71.4 mt -83.15 -34.12 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 125.018 1.327 . . . . 0.0 110.11 -176.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.59 -36.78 93.7 Favored Glycine 0 C--N 1.336 0.538 0 CA-C-N 118.997 0.817 . . . . 0.0 112.157 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.7 t -56.81 -47.8 82.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 CA-C-N 117.474 0.637 . . . . 0.0 109.972 175.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 mp -60.02 -46.77 88.39 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.688 0.676 . . . . 0.0 109.27 177.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.7 -25.5 68.23 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.89 -24.31 10.77 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 119.059 0.845 . . . . 0.0 112.225 176.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mp -62.68 -28.14 69.73 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.067 1.933 . . . . 0.0 110.391 165.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.59 -24.0 61.03 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.094 1.358 . . . . 0.0 113.289 172.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.7 mm -142.38 93.12 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 125.255 1.422 . . . . 0.0 107.428 -166.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.83 65.49 1.0 Allowed Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 125.783 1.633 . . . . 0.0 111.282 -176.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -60.98 -33.28 92.54 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.3 2.667 . . . . 0.0 111.643 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -71.25 -40.86 70.75 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.582 0.753 . . . . 0.0 109.343 -176.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.401 ' HA ' ' HG2' ' A' ' 43' ' ' GLN . 44.7 t90 -64.54 -37.52 87.84 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 121.985 -0.447 . . . . 0.0 111.22 173.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.78 -49.86 76.06 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 120.998 -1.064 . . . . 0.0 108.682 173.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -59.62 -48.04 83.22 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 116.879 -1.534 . . . . 0.0 113.161 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.401 ' HG2' ' HA ' ' A' ' 40' ' ' TRP . 0.0 OUTLIER -57.63 -38.95 75.86 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.167 1.349 . . . . 0.0 111.157 -176.052 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -75.64 -48.5 21.87 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.65 1.18 . . . . 0.0 110.732 -176.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.3 mm -59.62 -32.03 48.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 119.419 1.009 . . . . 0.0 111.151 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.7 -39.04 70.48 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.458 1.026 . . . . 0.0 111.329 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -110.11 19.81 18.56 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.851 1.26 . . . . 0.0 111.758 176.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.78 14.54 3.27 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 120.247 -1.533 . . . . 0.0 113.808 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -69.94 -6.61 34.22 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.529 1.932 . . . . 0.0 113.422 -171.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.3 tp -86.01 131.01 34.37 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.086 1.354 . . . . 0.0 108.275 -172.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 98.8 t -106.44 131.07 57.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 171.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -94.09 116.36 28.77 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 161.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -144.3 164.06 27.7 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 171.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 22.8 mm -101.62 140.99 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -177.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.549 HG13 HG11 ' A' ' 61' ' ' VAL . 31.1 t -51.7 -73.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 125.876 1.67 . . . . 0.0 110.927 175.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? 56.62 166.01 0.06 OUTLIER Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 125.728 1.611 . . . . 0.0 112.84 -168.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -70.34 75.85 1.42 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 121.746 1.631 . . . . 0.0 109.061 160.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.1 t -130.51 -56.02 1.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.053 1.341 . . . . 0.0 110.986 -167.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -130.46 176.14 8.39 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.194 0.998 . . . . 0.0 108.625 -171.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.5 m -57.92 113.95 2.11 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.594 0.758 . . . . 0.0 109.814 171.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.549 HG11 HG13 ' A' ' 55' ' ' VAL . 6.1 m -137.98 159.34 68.89 Favored Pre-proline 0 C--O 1.239 0.521 0 O-C-N 121.965 -0.459 . . . . 0.0 110.236 174.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -72.26 175.64 9.68 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 123.578 2.852 . . . . 0.0 111.475 169.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.26 152.19 43.53 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 123.867 0.867 . . . . 0.0 111.34 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.65 28.93 33.87 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.856 -0.969 . . . . 0.0 114.483 162.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.0 m -140.52 28.68 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 124.405 1.082 . . . . 0.0 111.203 -174.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -64.0 -16.16 60.99 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 -153.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -151.51 29.14 0.62 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 127.609 2.363 . . . . 0.0 108.496 173.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -71.46 148.31 46.97 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 172.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.432 ' HB2' ' CE1' ' A' ' 84' ' ' PHE . 0.0 OUTLIER -77.97 142.49 38.29 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 166.01 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -128.06 135.31 49.66 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.874 0.87 . . . . 0.0 109.412 170.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.23 131.39 46.2 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 172.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.422 ' HB ' HG13 ' A' ' 81' ' ' ILE . 7.5 p -151.39 166.66 1.95 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 172.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.4 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -95.01 156.26 16.39 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 165.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.41 -16.14 53.21 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -113.21 -2.01 14.2 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.77 1.228 . . . . 0.0 111.978 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.4 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 31.6 m-20 -110.43 22.77 15.09 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.373 1.069 . . . . 0.0 110.08 -170.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -44.88 -63.95 0.81 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.267 1.027 . . . . 0.0 111.154 -174.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -82.75 -16.65 47.16 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.796 0.438 . . . . 0.0 110.196 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -54.76 -80.22 0.08 OUTLIER Glycine 0 CA--C 1.527 0.81 0 C-N-CA 127.994 2.711 . . . . 0.0 113.82 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -148.45 148.78 30.66 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.208 1.004 . . . . 0.0 108.683 -176.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.422 HG13 ' HB ' ' A' ' 72' ' ' VAL . 3.7 tt -150.67 148.49 15.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-N 119.175 0.898 . . . . 0.0 109.225 -177.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 50.1 mt -134.85 110.01 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 N-CA-C 107.823 -1.176 . . . . 0.0 107.823 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -85.83 146.62 26.67 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 169.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.432 ' CE1' ' HB2' ' A' ' 69' ' ' SER . 26.3 p90 -149.59 164.47 35.03 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.626 -1.296 . . . . 0.0 110.152 167.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.65 124.31 4.94 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 167.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.84 124.89 28.68 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 161.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -123.21 115.51 21.87 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 166.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 70.24 -96.77 0.56 Allowed Glycine 0 CA--C 1.523 0.575 0 C-N-CA 124.102 0.858 . . . . 0.0 112.817 175.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -136.29 21.31 3.19 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.572 1.949 . . . . 0.0 110.364 -177.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.0 m -125.97 149.28 48.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.63 1.572 . . . . 0.0 107.368 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 60.0 t -122.41 130.54 74.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.376 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 166.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.444 ' N ' HD12 ' A' ' 92' ' ' ILE . 1.1 mp -106.66 92.82 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 176.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.6 mt -77.87 129.91 36.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -131.06 98.12 4.49 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 125.535 1.534 . . . . 0.0 107.089 -174.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -124.15 164.65 19.04 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.613 -1.305 . . . . 0.0 110.461 -168.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.1 t -156.49 160.51 39.61 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.121 0.568 . . . . 0.0 109.64 174.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.9 p -108.7 8.2 26.78 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.17 1.788 . . . . 0.0 110.987 171.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -152.63 101.97 2.68 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 127.148 2.179 . . . . 0.0 106.711 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 tpt180 -44.26 -50.61 8.84 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 130.92 3.688 . . . . 0.0 110.594 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.512 HD22 HG23 ' A' ' 101' ' ' THR . 0.3 OUTLIER -75.35 3.5 8.94 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -176.492 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.512 HG23 HD22 ' A' ' 100' ' ' ASN . 21.0 p -119.85 165.52 14.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.849 0.356 . . . . 0.0 110.903 171.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' A' ' 103' ' ' LEU . 10.5 ptmt -65.49 173.28 2.77 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 122.669 1.223 . . . . 0.0 111.379 -177.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.412 ' O ' ' HE2' ' A' ' 102' ' ' LYS . 2.9 mm? -82.3 153.49 25.8 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.84 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.68 -179.7 1.86 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.855 0.862 . . . . 0.0 109.024 156.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -138.61 120.0 14.86 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.559 1.144 . . . . 0.0 108.211 169.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 mttm -112.08 106.27 14.86 Favored 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 158.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -84.06 135.48 34.4 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 160.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -134.48 158.17 44.62 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.774 1.63 . . . . 0.0 106.763 169.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.9 p -69.42 155.13 40.95 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.634 161.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.0 mt -58.4 -30.54 66.92 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.703 -0.623 . . . . 0.0 111.313 169.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.0 t -64.76 -44.05 91.33 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 117.323 -1.322 . . . . 0.0 111.447 173.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -57.08 10.37 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 120.053 1.297 . . . . 0.0 109.561 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 16.0 mt -58.49 -44.85 89.54 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.314 1.445 . . . . 0.0 111.156 -179.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -61.22 -38.69 87.51 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.529 -0.732 . . . . 0.0 110.944 177.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -81.74 -19.25 41.79 Favored 'General case' 0 C--O 1.223 -0.329 0 O-C-N 120.463 -1.398 . . . . 0.0 111.127 -175.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -79.03 -50.64 10.76 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.544 1.138 . . . . 0.0 111.328 171.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -123.03 18.1 10.04 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 121.16 -0.962 . . . . 0.0 112.608 -165.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.463 ' CZ ' ' HE2' ' A' ' 124' ' ' LYS . 2.9 t80 -148.39 30.99 0.83 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 120.535 -1.353 . . . . 0.0 110.066 175.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.531 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.4 OUTLIER -63.97 -65.2 0.71 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 -176.065 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.5 p -75.89 175.77 8.46 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.617 0.767 . . . . 0.0 111.285 -169.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -42.38 11.98 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 121.116 -0.99 . . . . 0.0 110.235 173.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.2 m -57.77 -39.84 78.4 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-N 118.923 0.783 . . . . 0.0 111.374 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.531 HE22 ' NE2' ' A' ' 119' ' ' GLN . 7.8 tt0 -58.65 -25.54 62.87 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.225 1.01 . . . . 0.0 111.976 -178.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.463 ' HE2' ' CZ ' ' A' ' 118' ' ' TYR . 7.7 mtpt -63.47 -21.26 66.21 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.532 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -65.35 -64.3 0.89 Allowed 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 167.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -48.74 76.38 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 123.405 0.682 . . . . 0.0 112.254 -168.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.12 -54.04 31.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -66.13 -18.25 65.23 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -75.25 -44.08 48.01 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 125.461 1.504 . . . . 0.0 109.735 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -59.67 -32.02 70.1 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.848 0.859 . . . . 0.0 110.07 171.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 38.8 t -69.96 -20.53 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 O-C-N 120.654 -1.279 . . . . 0.0 111.977 172.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -118.39 20.98 12.88 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.92 1.288 . . . . 0.0 111.438 -173.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -134.75 18.41 4.08 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 127.315 2.388 . . . . 0.0 110.857 169.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -90.55 164.95 14.03 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 123.976 0.911 . . . . 0.0 110.151 169.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.47 165.36 11.08 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.719 1.608 . . . . 0.0 107.157 162.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -136.15 -4.96 2.12 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 124.519 1.127 . . . . 0.0 111.776 -167.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 . . . . . 0 C--O 1.247 0.931 0 C-N-CA 131.246 3.818 . . . . 0.0 102.638 -172.585 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 . . . . . 0 N--CA 1.451 -0.408 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 p -121.09 162.62 19.72 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 161.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -62.7 -35.13 78.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.561 0.696 . . . . 0.0 110.3 -165.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -43.3 95.27 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.486 1.115 . . . . 0.0 110.59 177.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -58.68 -47.52 84.22 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.836 0.854 . . . . 0.0 108.748 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 88.0 mt -65.07 -41.9 93.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 123.722 0.809 . . . . 0.0 109.371 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.65 -43.75 91.31 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 123.657 0.646 . . . . 0.0 112.667 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.9 t -60.76 -51.62 71.07 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 C-N-CA 123.493 0.717 . . . . 0.0 109.34 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.3 -33.39 75.4 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.532 1.06 . . . . 0.0 111.76 -175.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.1 95.23 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 122.835 0.454 . . . . 0.0 110.033 173.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.84 7.09 44.4 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-O 118.445 -1.197 . . . . 0.0 113.091 173.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -100.8 -8.9 22.23 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 119.788 1.794 . . . . 0.0 111.753 162.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -98.99 -10.03 23.21 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.157 0.983 . . . . 0.0 113.414 173.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.479 HD12 ' CE2' ' A' ' 95' ' ' TYR . 40.5 mm -139.73 93.61 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 129.684 3.194 . . . . 0.0 107.484 -172.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 63.01 73.42 0.51 Allowed Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -78.86 -30.31 2.94 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.439 2.093 . . . . 0.0 111.588 -171.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.51 -44.22 91.6 Favored 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 125.391 1.476 . . . . 0.0 109.743 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.409 ' CZ3' HD12 ' A' ' 82' ' ' ILE . 63.9 t90 -52.37 -62.54 1.58 Allowed 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 125.172 1.389 . . . . 0.0 110.093 168.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.0 tt -52.16 -51.94 54.9 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 118.704 0.684 . . . . 0.0 111.471 -175.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.1 mttm -59.25 -44.92 92.36 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.343 -0.837 . . . . 0.0 111.413 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -60.98 -45.48 94.61 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.633 1.106 . . . . 0.0 110.631 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -58.26 -42.88 87.4 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 29.6 mm -64.78 -46.11 93.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 118.741 0.7 . . . . 0.0 110.178 176.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.36 -20.27 53.41 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.618 1.099 . . . . 0.0 112.311 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -102.16 1.14 35.73 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.623 1.569 . . . . 0.0 112.623 174.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 44.95 33.96 1.14 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.497 2.319 . . . . 0.0 111.14 -170.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -88.97 -18.08 28.16 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.802 2.041 . . . . 0.0 112.976 -173.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.88 130.5 37.67 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.484 1.514 . . . . 0.0 109.458 -163.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 55.6 t -108.52 156.9 8.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-O 122.955 1.359 . . . . 0.0 108.215 172.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -126.96 138.37 53.26 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.516 2.326 . . . . 0.0 105.249 176.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -161.62 -178.84 35.89 Favored Glycine 0 N--CA 1.445 -0.724 0 CA-C-O 122.241 0.912 . . . . 0.0 112.428 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.4 mm -124.48 134.85 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 C-N-CA 129.161 2.984 . . . . 0.0 104.73 -173.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.487 HG13 HG21 ' A' ' 61' ' ' VAL . 21.3 t -44.73 -53.96 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 C-N-CA 124.104 0.962 . . . . 0.0 113.287 -176.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.9 mmtt 65.16 156.31 0.12 Allowed Pre-proline 0 CA--C 1.532 0.257 0 C-N-CA 129.213 3.005 . . . . 0.0 111.09 -171.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.96 -3.11 7.74 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 124.103 3.202 . . . . 0.0 113.897 -176.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -120.02 -2.41 10.25 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.796 -1.19 . . . . 0.0 113.904 -162.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -89.58 173.01 8.55 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 120.814 1.643 . . . . 0.0 113.471 -170.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.6 t -76.33 35.75 0.15 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 129.51 3.124 . . . . 0.0 112.682 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.487 HG21 HG13 ' A' ' 55' ' ' VAL . 2.5 m -90.33 151.87 45.0 Favored Pre-proline 0 CA--C 1.536 0.441 0 O-C-N 120.675 -1.266 . . . . 0.0 113.502 -163.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.0 158.11 56.21 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.398 2.732 . . . . 0.0 110.278 176.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.93 144.27 56.33 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 123.393 0.677 . . . . 0.0 109.479 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.85 20.89 45.04 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-N 119.164 0.893 . . . . 0.0 113.429 176.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.4 m -140.29 90.81 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 104.308 -2.479 . . . . 0.0 104.308 166.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -92.42 -15.89 26.61 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -169.7 46.37 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.999 1.72 . . . . 0.0 110.956 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.401 ' O ' HG23 ' A' ' 55' ' ' VAL . 4.9 m-85 -94.9 114.96 26.87 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 162.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.83 154.41 7.18 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.439 1.018 . . . . 0.0 110.424 173.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 38.7 p90 -130.78 153.74 48.74 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.326 0.651 . . . . 0.0 110.447 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -119.1 134.45 55.19 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 126.767 2.027 . . . . 0.0 106.573 170.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.6 p -147.89 158.42 8.38 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 N-CA-C 104.722 -2.325 . . . . 0.0 104.722 171.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.75 164.6 17.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.931 1.241 . . . . 0.0 107.905 168.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.63 0.4 26.6 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 121.354 -0.841 . . . . 0.0 112.807 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -137.87 4.03 2.51 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.492 1.042 . . . . 0.0 112.678 -168.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -128.31 34.0 4.62 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.483 1.913 . . . . 0.0 109.569 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -56.79 -13.38 2.51 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -163.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.42 7.06 7.67 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 121.064 1.756 . . . . 0.0 111.893 174.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -82.38 -71.28 1.31 Allowed Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 126.494 1.997 . . . . 0.0 110.065 -178.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.8 m -118.79 171.13 8.43 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 117.981 0.891 . . . . 0.0 109.462 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.0 tt -168.32 148.52 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.521 0 C-N-CA 126.958 2.103 . . . . 0.0 106.945 158.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.409 HD12 ' CZ3' ' A' ' 40' ' ' TRP . 73.5 mt -132.58 131.2 60.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.106 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 173.137 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -105.52 151.5 24.22 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 125.583 1.553 . . . . 0.0 108.69 172.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -144.08 156.93 44.56 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.678 1.191 . . . . 0.0 108.783 170.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.401 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 18.0 tttt -144.91 134.53 23.36 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 161.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.41 123.22 21.24 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 159.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -99.09 23.16 9.38 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.013 0.925 . . . . 0.0 109.037 165.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 76.8 115.08 0.14 Allowed Glycine 0 C--N 1.34 0.772 0 C-N-CA 125.963 1.744 . . . . 0.0 110.821 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 61.54 0.77 0.5 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.718 1.607 . . . . 0.0 113.645 -173.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.41 149.78 38.13 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.556 2.342 . . . . 0.0 106.628 177.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.78 129.57 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 172.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 19.4 mm -100.09 112.96 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 174.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.5 mt -101.43 118.07 47.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.467 ' HB3' HD13 ' A' ' 103' ' ' LEU . 72.9 mttt -116.72 104.99 11.91 Favored 'General case' 0 C--O 1.223 -0.306 0 C-N-CA 126.936 2.094 . . . . 0.0 107.17 -172.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.479 ' CE2' HD12 ' A' ' 36' ' ' ILE . 40.1 p90 -125.79 169.71 12.33 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.164 -1.585 . . . . 0.0 110.761 -177.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.1 t -151.26 168.7 23.94 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.149 1.38 . . . . 0.0 108.317 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.9 p -88.65 -12.73 41.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.664 1.185 . . . . 0.0 113.178 167.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -150.1 137.36 19.64 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.55 0.74 . . . . 0.0 109.771 -174.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -60.14 -21.03 61.11 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.577 1.551 . . . . 0.0 112.04 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -94.47 2.4 55.73 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.6 p -121.88 156.35 33.5 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.352 0.978 . . . . 0.0 112.771 -172.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.2 tmtt? -64.4 135.62 56.3 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 124.63 1.172 . . . . 0.0 109.819 -169.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.467 HD13 ' HB3' ' A' ' 94' ' ' LYS . 83.4 mt -72.81 143.9 47.71 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 123.984 0.914 . . . . 0.0 109.763 -176.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -71.24 -171.69 0.62 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.226 1.41 . . . . 0.0 109.439 171.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.93 103.91 4.09 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.114 -0.991 . . . . 0.0 110.172 170.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -85.3 147.53 26.5 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 106.147 -1.797 . . . . 0.0 106.147 147.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -137.5 127.31 25.53 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 168.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.4 mt -141.67 139.26 32.94 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -168.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 16.9 p -69.28 154.64 41.71 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.319 0.963 . . . . 0.0 109.873 173.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 20.4 mt -59.45 -28.54 67.08 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.314 -0.866 . . . . 0.0 110.046 168.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.46 -29.94 65.44 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.81 -0.556 . . . . 0.0 112.329 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.11 -59.84 2.66 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 105.856 -1.905 . . . . 0.0 105.856 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.61 -37.08 72.67 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.76 1.224 . . . . 0.0 113.138 -175.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -70.57 -31.75 68.89 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.49 -0.756 . . . . 0.0 110.21 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.401 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -67.78 -63.02 1.14 Allowed 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 174.743 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -46.88 -53.55 11.89 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.315 1.446 . . . . 0.0 111.59 -173.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -119.14 11.46 12.38 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 121.827 -0.546 . . . . 0.0 111.953 -163.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -149.44 34.85 0.71 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.65 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -81.08 -40.33 24.29 Favored 'General case' 0 C--N 1.342 0.278 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.334 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 16.6 p -89.02 -178.84 5.79 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.899 1.681 . . . . 0.0 110.543 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 -88.45 -45.41 9.98 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 120.994 -1.066 . . . . 0.0 109.314 170.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 37.3 p -66.63 -30.27 70.51 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.301 0.955 . . . . 0.0 111.213 -175.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.65 HE22 ' NE2' ' A' ' 119' ' ' GLN . 12.0 tt0 -58.43 -30.96 67.31 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.256 0.934 . . . . 0.0 110.618 176.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -59.76 -27.22 66.34 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 121.612 -0.68 . . . . 0.0 111.78 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.18 -50.23 61.76 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.045 1.338 . . . . 0.0 108.853 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.85 -48.68 75.78 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.679 0.752 . . . . 0.0 111.815 176.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 54.8 t -53.98 -54.48 20.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.382 -177.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -63.79 -24.99 67.98 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 177.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -64.08 -43.66 94.73 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.852 0.751 . . . . 0.0 110.244 171.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -60.05 -37.07 78.75 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.619 1.099 . . . . 0.0 110.418 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 22.0 t -71.05 -8.85 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 123.626 0.77 . . . . 0.0 111.61 178.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -117.57 -14.53 10.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.741 1.216 . . . . 0.0 113.376 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -97.86 -5.37 57.54 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 125.793 1.663 . . . . 0.0 112.716 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -68.32 170.95 7.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 122.205 1.002 . . . . 0.0 110.352 165.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -127.49 174.43 9.03 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 126.927 2.091 . . . . 0.0 107.357 172.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.9 m -149.0 16.97 0.96 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.674 1.125 . . . . 0.0 112.722 -171.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 C--O 1.252 1.222 0 C-N-CA 125.732 1.613 . . . . 0.0 108.918 -171.243 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 12.0 m-30 . . . . . 0 CA--C 1.544 0.749 0 CA-C-O 121.178 0.513 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -138.66 150.73 46.53 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 129.313 3.045 . . . . 0.0 107.972 177.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -51.07 -40.95 59.53 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.978 0.911 . . . . 0.0 110.188 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -53.19 -59.47 4.52 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.459 1.503 . . . . 0.0 112.52 174.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -63.46 -26.16 68.6 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.608 1.563 . . . . 0.0 111.407 -175.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 93.1 mt -78.55 -40.62 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 C-N-CA 125.184 1.394 . . . . 0.0 109.742 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.7 -40.66 89.03 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 124.679 1.133 . . . . 0.0 112.431 -175.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.8 t -66.29 -49.37 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.3 mp -54.05 -49.6 68.64 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.202 0.91 . . . . 0.0 110.68 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.6 -38.01 86.04 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.1 0.56 . . . . 0.0 111.248 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.88 -32.58 73.82 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 111.81 -0.516 . . . . 0.0 111.81 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.0 mt -64.94 -23.32 67.19 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 120.468 -1.607 . . . . 0.0 111.671 176.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.457 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -79.98 -17.59 52.51 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.358 -0.839 . . . . 0.0 112.96 171.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.529 HD11 ' HE2' ' A' ' 106' ' ' LYS . 2.9 mp -134.52 97.73 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 125.797 1.639 . . . . 0.0 107.428 -172.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.92 54.96 1.25 Allowed Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.02 0.928 . . . . 0.0 110.605 175.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -56.05 -39.57 90.39 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 123.262 2.641 . . . . 0.0 111.246 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -67.34 -34.4 77.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.803 1.241 . . . . 0.0 112.527 -175.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 34.9 t90 -63.68 -54.33 37.22 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 173.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 tt -50.96 -48.4 61.01 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.158 0.583 . . . . 0.0 110.748 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -59.32 -47.42 85.48 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.904 0.882 . . . . 0.0 111.306 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -58.58 -40.21 82.51 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 120.779 1.627 . . . . 0.0 112.346 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -67.01 -45.02 78.85 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.991 0.9 . . . . 0.0 109.205 -177.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.592 HD11 HD22 ' A' ' 50' ' ' LEU . 96.1 mt -71.8 -32.32 44.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 O-C-N 121.422 -0.799 . . . . 0.0 109.52 -178.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.83 -4.17 33.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.88 0.872 . . . . 0.0 112.581 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.0 -16.24 26.79 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.134 0.879 . . . . 0.0 111.673 160.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 68.83 30.26 4.81 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 127.829 2.452 . . . . 0.0 109.287 -170.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -94.96 -89.15 0.24 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 119.023 -0.513 . . . . 0.0 109.66 178.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.723 HD23 ' HB3' ' A' ' 134' ' ' LEU 0.314 13.0 tp 40.9 97.28 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 129.592 3.157 . . . . 0.0 113.921 175.41 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.9 t -96.14 143.51 12.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 120.096 1.316 . . . . 0.0 109.003 -177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -119.65 137.35 53.94 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 128.139 2.576 . . . . 0.0 107.831 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.15 174.77 32.56 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 176.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.6 mm -116.99 146.2 21.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 172.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.5 t -49.91 -77.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 126.299 1.84 . . . . 0.0 110.755 176.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.6 mttt 57.47 165.81 0.07 OUTLIER Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 125.833 1.653 . . . . 0.0 111.77 -165.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -75.46 -32.85 4.57 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 CA-C-N 120.332 1.154 . . . . 0.0 112.777 -176.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 47.2 t -80.11 67.55 5.96 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.061 1.345 . . . . 0.0 109.043 -177.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -157.2 -167.19 2.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.033 1.733 . . . . 0.0 107.29 159.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.2 m -109.85 105.13 14.21 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 120.238 1.381 . . . . 0.0 107.622 174.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -138.08 159.21 69.25 Favored Pre-proline 0 C--O 1.237 0.446 0 CA-C-N 118.995 0.816 . . . . 0.0 112.709 -171.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -72.86 164.38 35.73 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.467 2.778 . . . . 0.0 111.263 173.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.52 137.68 58.31 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.581 169.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.2 31.42 11.9 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-O 119.392 -0.671 . . . . 0.0 113.725 164.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 13.9 m -135.74 22.72 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-N 118.549 1.175 . . . . 0.0 109.988 171.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -63.27 -9.59 12.26 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 116.928 2.196 . . . . 0.0 116.928 -150.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -147.52 26.61 1.04 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 128.703 2.801 . . . . 0.0 111.324 172.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -78.49 153.93 30.95 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.064 0.946 . . . . 0.0 109.254 176.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.2 m -76.17 151.73 36.85 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 124.499 1.12 . . . . 0.0 108.684 163.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -133.85 145.56 49.8 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 124.129 0.972 . . . . 0.0 110.375 167.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 18.6 mt -115.75 137.77 51.76 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.406 1.883 . . . . 0.0 106.213 175.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 p -149.66 167.8 2.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 104.425 -2.435 . . . . 0.0 104.425 -179.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -109.75 153.59 24.12 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 120.213 -1.555 . . . . 0.0 108.326 167.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.52 3.02 12.22 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -100.33 -47.85 4.78 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 118.866 0.757 . . . . 0.0 109.977 159.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -76.58 24.91 0.14 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.138 1.775 . . . . 0.0 112.453 -174.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -56.09 -28.87 59.44 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.555 1.542 . . . . 0.0 113.683 -164.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -128.0 11.71 6.59 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 127.139 2.176 . . . . 0.0 111.174 174.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -88.18 -56.92 1.97 Allowed Glycine 0 CA--C 1.53 0.98 0 C-N-CA 125.369 1.461 . . . . 0.0 111.105 176.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 75.0 m -127.97 161.4 29.22 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.102 1.361 . . . . 0.0 108.016 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.8 tt -156.98 154.85 5.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 O-C-N 120.382 -1.449 . . . . 0.0 107.671 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 64.5 mt -135.02 150.42 29.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 169.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -124.24 158.86 31.49 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 126.977 2.111 . . . . 0.0 108.917 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -162.72 162.74 26.93 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.974 0.909 . . . . 0.0 110.1 171.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.5 131.09 10.63 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 170.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.78 150.38 24.61 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 123.957 0.785 . . . . 0.0 109.554 171.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -117.04 -3.45 11.57 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.256 1.822 . . . . 0.0 111.253 174.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 135.96 -37.19 1.93 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 124.879 1.228 . . . . 0.0 112.258 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.418 ' O ' ' HG ' ' A' ' 110' ' ' LEU . 0.5 OUTLIER -131.13 -59.54 0.98 Allowed 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 125.951 1.7 . . . . 0.0 107.14 166.79 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.4 m -73.16 143.07 47.39 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 119.604 -1.935 . . . . 0.0 110.559 -175.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 71.3 t -133.35 116.06 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 -175.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.8 mp -84.36 94.71 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.467 HG21 HD13 ' A' ' 36' ' ' ILE . 4.4 mt -71.24 127.94 33.8 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 171.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.9 mttt -129.01 108.34 10.32 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -129.37 168.47 16.23 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 121.133 -0.979 . . . . 0.0 109.938 -171.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.5 t -154.63 169.62 23.44 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.524 1.129 . . . . 0.0 108.778 -176.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.6 p -99.32 -14.02 19.39 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.661 0.784 . . . . 0.0 111.86 162.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -134.71 126.93 30.02 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.337 1.055 . . . . 0.0 111.556 -176.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 57.4 ttt-85 -56.59 -30.33 63.07 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 126.681 1.992 . . . . 0.0 112.579 -173.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.92 50.28 1.09 Allowed 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 124.767 1.227 . . . . 0.0 109.889 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.1 p -135.74 156.69 48.43 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.245 1.018 . . . . 0.0 108.511 164.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.33 149.17 46.38 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.247 -0.908 . . . . 0.0 111.15 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -83.89 154.54 23.37 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.983 1.313 . . . . 0.0 110.97 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -71.44 171.29 11.55 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 125.876 1.671 . . . . 0.0 111.112 171.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -114.92 117.26 30.15 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.479 1.512 . . . . 0.0 108.565 167.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.529 ' HE2' HD11 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -134.61 115.62 14.06 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 104.114 -2.55 . . . . 0.0 104.114 156.033 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.09 122.39 39.94 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 -172.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.403 HD11 ' HD2' ' A' ' 106' ' ' LYS . 35.6 mt -138.46 145.55 41.0 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.567 1.147 . . . . 0.0 108.674 -168.276 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 20.7 p -77.18 151.63 35.18 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.313 0.506 . . . . 0.0 110.73 175.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 89' ' ' GLN . 12.3 mt -51.0 -42.08 60.11 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 122.237 1.017 . . . . 0.0 110.807 175.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -35.89 70.49 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 125.091 1.357 . . . . 0.0 111.547 -176.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -68.03 0.37 Allowed 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 126.575 1.95 . . . . 0.0 109.652 174.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.61 -38.02 71.48 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.657 1.183 . . . . 0.0 111.279 -173.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -60.32 -34.14 73.38 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.956 0.502 . . . . 0.0 112.155 176.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -69.27 -58.94 3.38 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 120.787 -1.195 . . . . 0.0 108.069 173.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -45.87 -57.25 4.49 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.97 2.108 . . . . 0.0 110.537 -175.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -120.49 12.81 11.66 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.041 1.336 . . . . 0.0 112.298 -163.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -147.84 28.44 0.94 Allowed 'General case' 0 C--N 1.342 0.268 0 CA-C-N 120.08 1.309 . . . . 0.0 114.19 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.62 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -68.82 -60.14 2.59 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 120.758 -1.214 . . . . 0.0 111.915 179.543 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 11.0 t -99.6 163.63 12.42 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 125.362 1.465 . . . . 0.0 109.88 -164.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 53.2 mtt-85 -80.2 -38.29 31.48 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -167.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 8.1 t -57.45 -38.63 74.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.708 0.686 . . . . 0.0 109.654 174.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.62 HE22 ' NE2' ' A' ' 119' ' ' GLN . 13.0 tt0 -62.94 -25.31 68.28 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.684 -0.635 . . . . 0.0 112.368 176.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -71.66 -12.86 61.55 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 117.511 -1.233 . . . . 0.0 111.885 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -71.19 -73.07 0.19 Allowed 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 115.993 -1.956 . . . . 0.0 106.353 162.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -47.71 -55.14 10.16 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 120.243 1.383 . . . . 0.0 112.437 -166.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 78.3 t -54.45 -50.14 60.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 123.59 0.756 . . . . 0.0 110.391 -175.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.71 -34.03 73.33 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 176.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -64.14 -31.62 72.88 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 125.816 1.646 . . . . 0.0 108.835 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.436 ' HA ' HD13 ' A' ' 45' ' ' ILE . 22.0 m-30 -68.39 -41.42 80.56 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.348 1.459 . . . . 0.0 110.957 171.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.67 -35.14 74.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-N 119.296 0.953 . . . . 0.0 109.288 172.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -80.56 10.09 5.22 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.913 -1.117 . . . . 0.0 112.712 172.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -129.72 -5.15 4.56 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 125.954 1.74 . . . . 0.0 112.181 -172.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.723 ' HB3' HD23 ' A' ' 50' ' ' LEU . 4.0 pp -84.38 176.42 8.7 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 118.15 0.975 . . . . 0.0 110.377 167.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -138.2 163.37 31.88 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 128.7 2.8 . . . . 0.0 105.536 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.42 -5.79 15.1 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.244 1.021 . . . . 0.0 110.71 178.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 . . . . . 0 C--O 1.254 1.311 0 C-N-CA 130.169 3.387 . . . . 0.0 105.955 -177.329 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 . . . . . 0 CA--C 1.537 0.464 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.88 152.69 49.08 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.492 1.117 . . . . 0.0 110.124 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -48.44 -41.38 29.18 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.496 1.118 . . . . 0.0 110.193 173.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -50.31 -63.58 1.08 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.406 2.282 . . . . 0.0 110.487 174.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -70.34 -32.9 70.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.835 2.054 . . . . 0.0 111.354 -172.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 88.2 mt -71.93 -33.94 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 124.613 1.165 . . . . 0.0 108.818 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.36 -46.71 63.74 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 125.157 1.361 . . . . 0.0 111.06 -174.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 65.0 t -67.84 -46.62 81.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 123.276 0.63 . . . . 0.0 109.433 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.7 mp -58.78 -51.91 67.95 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.563 0.745 . . . . 0.0 111.503 -179.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.18 86.7 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.739 -0.648 . . . . 0.0 111.198 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.61 -28.6 72.07 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 118.79 0.723 . . . . 0.0 111.956 176.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mp -65.38 -24.93 67.36 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.35 -1.676 . . . . 0.0 112.44 176.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.42 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -78.57 -22.42 47.16 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 118.813 -0.613 . . . . 0.0 112.611 171.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.42 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.9 mp -130.1 92.12 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.519 1.528 . . . . 0.0 107.017 -172.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.16 63.78 1.08 Allowed Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 124.61 1.164 . . . . 0.0 111.594 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -59.31 -35.36 97.06 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.576 2.184 . . . . 0.0 111.165 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -68.86 -49.84 54.94 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.95 -175.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 59.5 t90 -52.22 -50.73 61.39 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 118.826 0.739 . . . . 0.0 109.796 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.1 tt -53.68 -59.27 4.83 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -62.86 -32.66 73.94 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 117.86 -1.067 . . . . 0.0 112.372 -175.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -63.85 -48.51 76.46 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 120.228 1.376 . . . . 0.0 108.858 176.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -65.85 -34.35 77.94 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 118.384 -0.817 . . . . 0.0 111.883 -177.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.517 HG21 ' CD1' ' A' ' 130' ' ' TYR . 45.1 mm -61.77 -49.72 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 119.428 1.013 . . . . 0.0 109.37 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.73 -3.08 4.27 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.083 0.953 . . . . 0.0 113.324 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.84 -7.07 14.21 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.645 1.978 . . . . 0.0 112.378 172.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.9 t30 44.61 38.67 2.83 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.171 2.188 . . . . 0.0 111.203 -167.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.37 -5.07 19.29 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.491 1.517 . . . . 0.0 111.438 -175.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.62 138.61 36.44 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 92.9 t -118.0 150.47 20.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 126.316 1.846 . . . . 0.0 106.784 175.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -124.82 142.83 51.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.258 3.023 . . . . 0.0 105.616 174.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -167.24 -178.95 39.88 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 27.8 mm -119.1 137.55 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 125.76 1.624 . . . . 0.0 106.83 -176.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.512 HG13 HG11 ' A' ' 61' ' ' VAL . 23.8 t -43.99 -71.98 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.725 1.21 . . . . 0.0 112.606 175.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 47.0 mttt 55.06 165.04 0.05 OUTLIER Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.708 1.603 . . . . 0.0 113.03 -164.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -78.84 -22.22 9.06 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 121.008 1.138 . . . . 0.0 111.009 175.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.9 m -77.29 19.56 0.33 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.189 1.796 . . . . 0.0 113.743 -172.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -132.8 177.89 7.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.598 1.559 . . . . 0.0 109.124 176.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.1 m -91.33 112.08 23.84 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.849 1.26 . . . . 0.0 107.902 173.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.512 HG11 HG13 ' A' ' 55' ' ' VAL . 5.7 m -144.47 162.23 40.37 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 123.665 0.786 . . . . 0.0 110.429 -177.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.25 -172.83 1.11 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.315 2.677 . . . . 0.0 112.211 171.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.04 162.23 28.56 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.297 1.039 . . . . 0.0 111.552 165.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.32 33.64 78.2 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 123.93 0.776 . . . . 0.0 113.514 160.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.9 m -144.14 27.15 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 118.39 1.095 . . . . 0.0 111.606 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.79 -16.35 4.34 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -163.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -149.62 15.4 0.87 Allowed 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 128.352 2.661 . . . . 0.0 110.424 -170.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -74.68 132.08 41.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.6 m -68.03 149.33 49.83 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 166.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -136.71 164.32 28.51 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.388 -0.82 . . . . 0.0 110.689 173.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 16.7 mt -139.23 135.88 34.39 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 126.968 2.107 . . . . 0.0 105.878 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.46 ' HB ' HG13 ' A' ' 81' ' ' ILE . 11.8 p -156.17 158.26 3.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -174.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.412 ' HB3' ' H ' ' A' ' 76' ' ' ASP . . . -84.97 154.31 22.23 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.107 -0.996 . . . . 0.0 108.391 168.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.49 -16.01 62.86 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.452 -0.785 . . . . 0.0 112.9 175.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -104.03 -39.19 6.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.667 173.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.412 ' H ' ' HB3' ' A' ' 73' ' ' ALA . 1.7 m-20 -82.15 28.79 0.43 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.634 1.174 . . . . 0.0 110.548 -167.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -49.71 -53.66 23.38 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 126.491 1.916 . . . . 0.0 110.534 -169.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -92.51 7.97 40.85 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.045 1.338 . . . . 0.0 113.045 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.2 -68.54 1.02 Allowed Glycine 0 CA--C 1.529 0.919 0 C-N-CA 126.263 1.887 . . . . 0.0 111.432 -176.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.7 m -134.8 143.09 46.88 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.814 1.307 . . . . 0.0 108.987 173.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.46 HG13 ' HB ' ' A' ' 72' ' ' VAL . 7.6 tt -143.44 157.89 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 171.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.2 mt -141.8 137.91 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 176.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -118.09 156.35 28.8 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 124.646 1.178 . . . . 0.0 108.64 176.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -161.02 158.47 27.94 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 120.997 -1.064 . . . . 0.0 110.593 174.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.53 110.16 4.67 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 166.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.24 124.71 32.19 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -151.87 150.79 30.48 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.307 2.243 . . . . 0.0 110.769 -177.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 46.42 53.4 9.66 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.872 1.225 . . . . 0.0 113.815 171.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 53.9 mm-40 57.73 12.11 1.54 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.498 1.919 . . . . 0.0 115.069 -172.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.5 m -128.08 170.23 13.17 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 128.443 2.697 . . . . 0.0 109.119 -168.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.6 p -156.05 109.59 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.689 0 O-C-N 121.003 -1.061 . . . . 0.0 112.616 174.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.665 HD12 ' H ' ' A' ' 92' ' ' ILE . 1.6 mp -79.03 95.38 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 173.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 19.2 mt -76.34 128.16 37.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 165.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -118.02 110.75 18.05 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 126.366 1.866 . . . . 0.0 106.405 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.413 ' CD2' HG12 ' A' ' 36' ' ' ILE . 34.7 p90 -126.78 164.96 20.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.146 0.884 . . . . 0.0 112.913 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.6 t -148.75 172.03 15.26 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.958 1.703 . . . . 0.0 108.615 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.6 p -114.93 -1.41 13.13 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.729 1.612 . . . . 0.0 111.953 169.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -143.21 143.28 31.69 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 160.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.0 mtm180 -60.44 -10.87 5.46 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -101.84 1.27 36.88 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.8 p -113.24 156.36 23.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.132 0.967 . . . . 0.0 112.612 -174.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -64.68 132.69 50.39 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 125.847 1.659 . . . . 0.0 109.926 -168.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.4 mt -78.23 140.58 38.9 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -173.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -66.9 -174.33 0.32 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.676 1.19 . . . . 0.0 110.793 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.32 101.83 4.63 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.381 1.072 . . . . 0.0 108.996 178.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -121.29 113.24 19.65 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 103.81 -2.663 . . . . 0.0 103.81 174.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -126.58 106.1 9.18 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 116.319 -1.8 . . . . 0.0 108.031 -166.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 26.7 mt -128.2 154.7 45.52 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 120.71 1.595 . . . . 0.0 109.143 -158.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 22.1 p -73.79 147.21 43.62 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 121.258 1.845 . . . . 0.0 111.44 176.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.6 mt -46.7 -48.89 20.13 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 122.919 1.343 . . . . 0.0 109.77 167.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.24 -15.69 62.46 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.01 0.924 . . . . 0.0 112.281 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -75.83 -56.47 4.64 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 171.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -55.14 -37.61 67.17 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.827 1.194 . . . . 0.0 111.834 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -56.83 -47.72 79.67 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.848 -0.533 . . . . 0.0 110.293 173.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -20.37 63.37 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.164 -0.922 . . . . 0.0 112.564 -176.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -83.01 -57.47 3.27 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.532 0.733 . . . . 0.0 110.952 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -116.28 0.94 13.0 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.391 -0.818 . . . . 0.0 113.064 -163.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.434 ' HA ' HE21 ' A' ' 123' ' ' GLN . 1.6 t80 -138.18 26.9 2.64 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -174.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.82 -26.96 40.33 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 174.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 66.2 p -80.09 -165.54 0.86 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.187 0.903 . . . . 0.0 110.972 -168.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 24.7 ttm-85 -114.53 -33.3 5.61 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.486 1.114 . . . . 0.0 111.779 172.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.3 p -62.11 -48.09 81.72 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 126.311 1.845 . . . . 0.0 110.874 174.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.434 HE21 ' HA ' ' A' ' 118' ' ' TYR . 2.7 pm0 -58.03 -25.79 61.6 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -172.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -65.44 -4.43 5.71 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.018 1.327 . . . . 0.0 112.774 175.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -80.08 -83.51 0.1 Allowed 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 105.255 -2.128 . . . . 0.0 105.255 154.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -55.01 -56.46 19.46 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 124.168 0.987 . . . . 0.0 113.533 -160.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.17 -21.77 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.131 0.972 . . . . 0.0 111.483 -175.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.62 -39.42 14.08 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.243 1.817 . . . . 0.0 109.924 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -59.55 -40.05 86.01 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 126.987 2.115 . . . . 0.0 110.667 174.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.517 ' CD1' HG21 ' A' ' 45' ' ' ILE . 17.8 m-30 -60.54 -33.08 72.14 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 125.201 1.4 . . . . 0.0 110.783 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 24.2 t -68.58 -13.9 17.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 O-C-N 121.583 -0.698 . . . . 0.0 110.772 175.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -116.08 17.64 15.74 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.286 1.434 . . . . 0.0 111.111 172.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -122.54 -10.61 5.91 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 126.214 1.864 . . . . 0.0 111.788 178.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.31 165.74 24.48 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.412 1.085 . . . . 0.0 108.928 157.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -110.81 162.49 14.74 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 127.426 2.29 . . . . 0.0 107.03 172.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.4 m -132.35 17.67 4.45 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.931 0.492 . . . . 0.0 110.376 176.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 . . . . . 0 C--O 1.25 1.122 0 C-N-CA 128.74 2.816 . . . . 0.0 108.15 -170.347 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 . . . . . 0 C--O 1.239 0.536 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 p -135.51 150.92 49.91 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 125.134 1.373 . . . . 0.0 108.585 177.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -57.35 -38.73 74.59 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.348 0.659 . . . . 0.0 110.819 -174.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -48.96 -61.28 2.14 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.465 2.306 . . . . 0.0 111.889 172.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 -66.74 -40.05 88.18 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.989 1.716 . . . . 0.0 109.456 -172.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.415 HG21 ' HB2' ' A' ' 86' ' ' ALA . 67.3 mt -61.89 -35.49 68.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 173.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.77 -51.05 59.31 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-O 118.187 -1.34 . . . . 0.0 111.232 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 76.3 t -58.3 -50.23 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 118.134 0.967 . . . . 0.0 109.18 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.4 mp -55.71 -49.82 71.99 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.259 1.024 . . . . 0.0 112.008 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.19 -42.78 93.25 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.919 -0.562 . . . . 0.0 111.32 -177.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.11 -25.24 74.54 Favored Glycine 0 C--N 1.337 0.629 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.095 176.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 tp -66.53 -24.15 66.34 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.307 -1.702 . . . . 0.0 111.74 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.425 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -77.92 -22.82 49.06 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 170.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.425 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.8 mp -136.59 101.34 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.543 1.537 . . . . 0.0 106.927 -170.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m 64.49 59.2 1.54 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.73 1.212 . . . . 0.0 112.904 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.82 -43.21 12.94 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.33 2.687 . . . . 0.0 112.165 176.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -53.74 -55.28 27.72 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.467 1.03 . . . . 0.0 110.164 -177.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 63.0 t90 -53.33 -42.17 66.46 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.61 1.164 . . . . 0.0 110.714 176.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.59 -53.6 32.67 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 -174.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -58.15 -44.22 87.74 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 123.857 0.863 . . . . 0.0 110.69 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -55.8 -52.35 64.31 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.939 0.896 . . . . 0.0 109.919 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -71.37 -24.39 62.07 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.498 -0.763 . . . . 0.0 111.482 -174.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.46 HG21 ' HD1' ' A' ' 130' ' ' TYR . 24.5 mm -72.18 -38.75 63.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 120.095 1.316 . . . . 0.0 110.579 167.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.09 -6.52 9.17 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.511 1.051 . . . . 0.0 112.756 -178.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.07 10.26 8.14 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.235 1.414 . . . . 0.0 112.267 167.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 50.67 27.44 2.98 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 128.78 2.832 . . . . 0.0 112.521 -178.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -82.77 -8.19 59.6 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 127.045 2.138 . . . . 0.0 112.823 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.8 tp -76.5 147.43 37.81 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.537 1.062 . . . . 0.0 110.225 -175.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.9 t -123.89 159.36 29.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 125.614 1.566 . . . . 0.0 107.782 170.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -129.65 144.54 51.33 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.669 2.787 . . . . 0.0 107.56 173.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -161.5 173.97 37.97 Favored Glycine 0 C--N 1.335 0.522 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 174.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 23.6 mm -106.3 147.77 11.42 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 168.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.631 HG13 HG11 ' A' ' 61' ' ' VAL . 26.7 t -50.72 -77.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 126.103 1.761 . . . . 0.0 112.346 173.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 38.3 mtmt 57.43 165.43 0.07 OUTLIER Pre-proline 0 CA--C 1.541 0.622 0 C-N-CA 126.477 1.911 . . . . 0.0 114.439 -170.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -78.83 64.62 8.76 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 123.078 2.518 . . . . 0.0 109.471 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.1 m -140.29 -17.02 0.92 Allowed 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.205 1.802 . . . . 0.0 112.728 -167.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -146.36 161.5 40.22 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 119.479 1.036 . . . . 0.0 108.985 -168.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 84.9 m -70.93 117.43 12.42 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 119.832 1.196 . . . . 0.0 107.969 173.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.631 HG11 HG13 ' A' ' 55' ' ' VAL . 30.4 m -139.96 159.37 64.76 Favored Pre-proline 0 C--O 1.236 0.352 0 C-N-CA 124.79 1.236 . . . . 0.0 109.161 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.491 ' HG3' HD21 ' A' ' 103' ' ' LEU . 83.9 Cg_endo -72.13 -178.44 3.23 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 121.72 1.614 . . . . 0.0 109.882 169.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.09 163.34 28.3 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.355 169.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.79 16.83 69.33 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-O 118.201 -1.333 . . . . 0.0 114.067 166.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.2 m -141.35 19.06 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 CA-C-N 119.115 1.458 . . . . 0.0 113.427 -171.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -57.22 -12.72 2.49 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 127.101 2.16 . . . . 0.0 116.245 -167.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -142.99 14.78 1.9 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.489 1.516 . . . . 0.0 111.813 175.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -70.07 148.1 49.2 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.181 -0.949 . . . . 0.0 108.993 176.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.3 m -72.89 157.79 36.76 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 124.14 0.976 . . . . 0.0 109.779 163.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -136.21 162.17 33.72 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.645 1.178 . . . . 0.0 110.146 163.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 10.1 mt -133.98 136.44 44.13 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 171.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.43 ' HB ' HG13 ' A' ' 81' ' ' ILE . 14.5 p -154.19 -177.99 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 104.9 -2.259 . . . . 0.0 104.9 -179.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -132.38 158.44 41.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 120.527 -1.358 . . . . 0.0 110.412 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.83 -17.26 62.75 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 125.653 1.581 . . . . 0.0 114.65 -161.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -117.41 -19.37 9.54 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.332 0.653 . . . . 0.0 111.404 175.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -88.82 38.35 0.88 Allowed 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.818 -1.176 . . . . 0.0 109.995 -178.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -50.98 -52.34 43.65 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.189 -0.944 . . . . 0.0 112.894 -167.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -95.86 2.68 53.83 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.946 0.499 . . . . 0.0 111.456 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.43 -66.66 1.96 Allowed Glycine 0 CA--C 1.527 0.833 0 C-N-CA 125.323 1.439 . . . . 0.0 112.602 -169.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.2 m -144.55 154.1 42.52 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.801 1.24 . . . . 0.0 107.707 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.43 HG13 ' HB ' ' A' ' 72' ' ' VAL . 6.6 tt -153.12 148.91 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-N 119.916 1.234 . . . . 0.0 108.161 174.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.484 HG23 ' HB3' ' A' ' 95' ' ' TYR . 24.0 mt -136.78 149.98 26.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 120.601 -1.312 . . . . 0.0 108.704 172.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -125.07 162.64 24.13 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 126.49 1.916 . . . . 0.0 109.369 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -162.16 160.36 27.08 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.103 -0.998 . . . . 0.0 111.777 175.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -142.88 111.34 6.21 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.907 0.883 . . . . 0.0 109.009 161.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HB2' HG21 ' A' ' 28' ' ' ILE . . . -81.86 102.74 11.04 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 173.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -96.2 90.49 5.51 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 126.389 1.876 . . . . 0.0 106.385 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.91 -137.4 43.93 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.71 5.22 0.13 Allowed 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 116.473 -1.727 . . . . 0.0 115.187 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.0 157.21 44.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 121.657 2.026 . . . . 0.0 110.61 -175.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.4 p -137.12 118.65 18.44 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 O-C-N 120.908 -1.12 . . . . 0.0 113.552 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 13.5 mm -78.5 94.05 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 172.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.421 ' CD1' HD23 ' A' ' 108' ' ' LEU . 27.1 mt -67.68 125.5 25.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 164.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -121.69 95.36 4.64 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 176.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.484 ' HB3' HG23 ' A' ' 82' ' ' ILE . 51.3 p90 -110.11 163.71 13.33 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.563 -1.336 . . . . 0.0 111.653 -177.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -147.23 166.73 26.14 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 170.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.3 p -98.24 -12.09 21.98 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.355 1.462 . . . . 0.0 111.108 171.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -140.13 132.88 29.02 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.924 0.89 . . . . 0.0 108.714 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -55.38 -25.67 36.76 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.04 1.336 . . . . 0.0 112.208 177.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.14 -5.29 59.06 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 118.293 2.701 . . . . 0.0 118.293 -178.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.6 p -116.71 161.53 19.1 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.488 1.04 . . . . 0.0 113.774 -169.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.1 tmtt? -64.76 153.08 40.91 Favored 'General case' 0 C--N 1.346 0.419 0 C-N-CA 123.249 0.62 . . . . 0.0 109.71 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.491 HD21 ' HG3' ' A' ' 62' ' ' PRO . 1.4 mm? -88.01 139.58 30.37 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.211 0.529 . . . . 0.0 109.694 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -61.45 174.32 0.76 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.961 0.904 . . . . 0.0 109.713 164.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -132.4 124.47 28.74 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 174.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -127.87 123.13 34.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 162.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.08 127.85 43.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 114.894 -2.479 . . . . 0.0 106.31 172.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.421 HD23 ' CD1' ' A' ' 93' ' ' ILE . 4.0 mm? -124.69 137.45 54.35 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 122.813 2.551 . . . . 0.0 108.479 179.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.9 p -64.6 148.43 50.87 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.213 172.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.5 mt -49.62 -42.21 44.34 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 121.35 0.595 . . . . 0.0 109.939 165.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.6 t -62.63 -45.77 91.32 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.459 -177.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -52.26 -61.02 2.54 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 118.551 0.614 . . . . 0.0 110.428 175.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.79 -32.62 72.92 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.714 0.265 . . . . 0.0 111.714 -171.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -66.12 -40.8 90.97 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.546 -0.721 . . . . 0.0 110.052 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -49.53 40.72 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 117.636 -1.173 . . . . 0.0 110.752 -177.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.16 -57.16 12.88 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.211 1.804 . . . . 0.0 108.367 177.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -118.55 16.49 13.73 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -159.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.509 ' CE1' ' HA ' ' A' ' 124' ' ' LYS . 1.5 t80 -147.21 26.59 1.07 Allowed 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -179.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.605 ' NE2' HE22 ' A' ' 123' ' ' GLN 0.272 0.0 OUTLIER -79.4 -52.96 7.39 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.891 -1.131 . . . . 0.0 113.793 -178.146 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.0 p -85.13 159.46 20.15 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.72 1.6 . . . . 0.0 111.638 -172.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -63.27 -45.05 93.3 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 116.774 -1.584 . . . . 0.0 113.932 176.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.7 t -61.49 -39.73 92.0 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 120.152 1.342 . . . . 0.0 108.815 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.605 HE22 ' NE2' ' A' ' 119' ' ' GLN . 11.7 tt0 -56.18 -39.21 72.03 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.509 ' HA ' ' CE1' ' A' ' 118' ' ' TYR . 7.0 mtpm? -58.54 -37.28 75.35 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 118.361 -0.828 . . . . 0.0 112.88 178.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -60.92 2.15 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.32 -52.79 33.75 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.253 1.421 . . . . 0.0 111.249 -177.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 91.1 t -55.67 -48.97 77.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 124.167 0.987 . . . . 0.0 111.194 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -67.12 -31.88 72.64 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.484 0.714 . . . . 0.0 111.663 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.31 -41.76 97.53 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.758 1.623 . . . . 0.0 109.913 175.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.46 ' HD1' HG21 ' A' ' 45' ' ' ILE . 40.5 m-85 -61.01 -38.44 86.09 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 122.86 0.464 . . . . 0.0 112.102 177.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.3 t -64.07 -41.39 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.695 0.68 . . . . 0.0 109.793 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.37 -13.16 61.77 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -102.2 11.5 57.07 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.086 1.327 . . . . 0.0 113.541 -171.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.5 pp -117.22 173.17 6.83 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.108 0.963 . . . . 0.0 110.201 174.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -125.78 167.87 14.59 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 125.231 1.412 . . . . 0.0 108.174 -171.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.91 -6.12 6.18 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 122.306 1.05 . . . . 0.0 113.06 -175.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.061 1 C-N-CA 131.808 4.043 . . . . 0.0 104.983 -174.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 . . . . . 0 CA--C 1.536 0.407 0 CA-C-O 121.626 0.727 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.31 149.51 42.2 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 165.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -62.39 -35.38 79.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.69 -163.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -43.27 92.87 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.315 0.646 . . . . 0.0 109.907 -178.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -61.32 -36.48 80.23 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 123.257 0.623 . . . . 0.0 109.75 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.5 mt -69.2 -45.4 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -59.7 -36.58 90.23 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.257 -0.746 . . . . 0.0 113.468 -175.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.75 -48.7 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 117.732 0.766 . . . . 0.0 109.501 174.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.89 -44.21 96.7 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 118.719 0.691 . . . . 0.0 110.279 -178.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.62 -43.92 72.67 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.763 0.825 . . . . 0.0 109.775 175.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.99 -35.3 78.5 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.7 mp -62.62 -18.19 61.76 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.274 2.037 . . . . 0.0 112.271 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.422 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -86.23 -17.38 34.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.633 1.573 . . . . 0.0 114.072 171.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.422 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.9 mp -135.91 96.21 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 126.883 2.073 . . . . 0.0 106.902 -177.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 58.99 73.59 0.68 Allowed Pre-proline 0 CA--C 1.543 0.712 0 C-N-CA 127.59 2.356 . . . . 0.0 112.388 -178.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -60.34 -46.14 19.46 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.724 2.949 . . . . 0.0 111.916 172.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.33 -27.78 69.28 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.257 0.623 . . . . 0.0 112.042 -174.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -65.03 -65.13 0.71 Allowed 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.286 -0.884 . . . . 0.0 109.024 172.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 tt -52.16 -47.54 65.4 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.0 0.92 . . . . 0.0 110.724 -174.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -59.9 -46.94 87.74 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.65 0.78 . . . . 0.0 110.391 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -61.51 -41.7 97.7 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 119.092 0.86 . . . . 0.0 111.501 173.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -61.03 -49.07 78.88 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.788 0.722 . . . . 0.0 109.171 -176.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.5 mm -61.52 -34.35 61.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 123.938 0.895 . . . . 0.0 110.478 177.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.11 -9.01 19.28 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.933 -1.105 . . . . 0.0 112.931 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -123.46 10.7 9.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.305 1.042 . . . . 0.0 112.42 167.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 52.12 34.49 14.33 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.065 1.746 . . . . 0.0 111.938 -175.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -87.64 -0.64 57.16 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 126.941 2.097 . . . . 0.0 114.638 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 tp -90.69 134.51 34.36 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.371 1.068 . . . . 0.0 109.306 -171.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 53.8 t -118.63 153.53 20.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 126.062 1.745 . . . . 0.0 108.053 174.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -135.26 148.19 49.49 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 127.724 2.41 . . . . 0.0 107.451 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -163.38 173.4 39.51 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 170.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 25.4 mm -95.9 148.1 5.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 161.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.474 HG13 HG21 ' A' ' 61' ' ' VAL . 21.5 t -44.59 -59.19 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 C-N-CA 126.752 2.021 . . . . 0.0 113.647 178.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 mttt 58.77 165.41 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 126.348 1.859 . . . . 0.0 113.522 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -73.76 -25.29 14.73 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 121.837 1.691 . . . . 0.0 111.749 174.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.41 63.77 0.98 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.093 1.757 . . . . 0.0 110.399 -170.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -158.09 -169.23 2.73 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.482 2.313 . . . . 0.0 106.752 169.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 20.5 m -118.97 110.46 17.15 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 120.271 1.396 . . . . 0.0 108.725 172.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.474 HG21 HG13 ' A' ' 55' ' ' VAL . 31.6 m -135.44 163.09 53.32 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 124.89 1.276 . . . . 0.0 112.138 -175.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -75.61 172.86 15.5 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.111 3.207 . . . . 0.0 112.266 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.74 135.39 40.33 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.766 0.826 . . . . 0.0 111.038 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.77 45.13 6.14 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 125.326 1.441 . . . . 0.0 113.163 168.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.7 m -138.84 38.61 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 125.874 1.67 . . . . 0.0 109.392 173.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -65.47 -15.96 63.17 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -148.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -148.27 17.14 1.06 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 127.572 2.349 . . . . 0.0 111.344 175.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.514 ' CG ' ' HB2' ' A' ' 85' ' ' LYS . 3.4 m-85 -61.6 152.66 29.97 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 122.017 0.913 . . . . 0.0 109.358 177.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m -75.01 153.97 38.24 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 126.32 1.848 . . . . 0.0 108.706 165.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 33.9 p90 -137.36 163.62 30.58 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.39 1.076 . . . . 0.0 110.69 167.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.4 mt -141.83 133.05 26.35 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 127.422 2.289 . . . . 0.0 106.726 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.415 ' HB ' HG13 ' A' ' 81' ' ' ILE . 8.8 p -159.05 159.63 2.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.349 1.06 . . . . 0.0 108.672 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.403 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -86.93 146.85 26.0 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 119.095 0.861 . . . . 0.0 109.905 177.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.28 -10.69 11.71 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 126.676 1.991 . . . . 0.0 114.024 176.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -136.36 -6.95 2.0 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 125.678 1.591 . . . . 0.0 113.395 -169.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.403 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 33.5 t70 -130.14 37.61 3.88 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 125.931 1.692 . . . . 0.0 107.512 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.18 -39.3 28.85 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.332 0.653 . . . . 0.0 111.531 -173.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -90.1 -7.15 54.48 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.594 1.157 . . . . 0.0 112.574 -174.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.62 -65.86 1.39 Allowed Glycine 0 C--N 1.334 0.461 0 C-N-CA 124.426 1.012 . . . . 0.0 111.895 -167.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.99 128.04 33.57 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 -171.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.415 HG13 ' HB ' ' A' ' 72' ' ' VAL . 4.0 tt -137.58 149.36 25.45 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 176.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.473 HG23 ' HB3' ' A' ' 95' ' ' TYR . 45.4 mt -133.64 138.11 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 172.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -111.06 152.24 27.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 126.298 1.839 . . . . 0.0 106.828 172.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -154.11 163.43 40.11 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 121.171 -0.955 . . . . 0.0 108.821 171.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.514 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -146.94 109.81 4.68 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 173.426 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -77.06 82.36 3.57 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.417 1.087 . . . . 0.0 108.702 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -74.14 179.53 4.39 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.232 2.213 . . . . 0.0 109.32 172.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.84 117.48 6.68 Favored Glycine 0 CA--C 1.531 1.042 0 O-C-N 120.533 -1.354 . . . . 0.0 112.127 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 53.68 11.45 0.31 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.582 2.353 . . . . 0.0 114.267 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.3 m -143.78 159.33 42.7 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 120.288 1.404 . . . . 0.0 109.151 -166.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.0 t -133.82 116.73 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 167.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.45 ' N ' HD12 ' A' ' 92' ' ' ILE . 2.5 mp -84.36 102.6 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 168.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.45 134.39 27.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 175.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -134.18 97.98 4.0 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.755 1.622 . . . . 0.0 108.465 -175.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.473 ' HB3' HG23 ' A' ' 82' ' ' ILE . 40.9 p90 -122.57 168.49 12.1 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.612 -1.305 . . . . 0.0 110.554 -172.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.9 t -153.1 167.24 29.9 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.509 1.124 . . . . 0.0 109.045 -173.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.5 p -88.77 -15.25 35.14 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.501 0.72 . . . . 0.0 112.422 166.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -150.53 147.03 26.98 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.541 0.736 . . . . 0.0 110.683 -170.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.33 11.2 0.09 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.366 1.866 . . . . 0.0 113.546 176.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.44 10.13 3.19 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 117.219 2.304 . . . . 0.0 117.219 -177.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -116.33 158.74 22.95 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.152 0.501 . . . . 0.0 110.509 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.15 131.02 42.94 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 -175.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.457 ' H ' HD22 ' A' ' 103' ' ' LEU . 1.8 mm? -64.3 146.32 54.58 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.294 0.569 . . . . 0.0 110.065 -177.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -59.69 172.1 0.77 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.168 0.987 . . . . 0.0 109.936 163.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -130.23 108.24 9.88 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.188 0.995 . . . . 0.0 108.445 168.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -116.96 85.09 2.26 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 104.17 -2.53 . . . . 0.0 104.17 172.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -79.73 137.77 37.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 171.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.6 mt -143.9 147.79 34.5 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.86 149.77 39.44 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 118.432 0.56 . . . . 0.0 110.554 171.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.43 -38.07 71.07 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.658 0.783 . . . . 0.0 110.528 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.3 t -55.37 -42.59 74.14 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.794 177.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -56.59 19.49 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 123.495 0.718 . . . . 0.0 110.189 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.0 mt -55.0 -39.97 69.63 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 122.771 0.429 . . . . 0.0 111.206 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -69.95 -37.97 75.99 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.795 0.438 . . . . 0.0 110.915 -178.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -29.29 64.23 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.565 1.146 . . . . 0.0 111.156 177.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -88.83 -42.86 11.63 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 118.045 -0.978 . . . . 0.0 112.174 -169.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -133.14 14.89 4.21 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.895 0.771 . . . . 0.0 112.754 -176.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -135.83 26.95 3.32 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.637 -1.289 . . . . 0.0 112.892 177.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -93.2 -21.52 19.59 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 126.774 2.03 . . . . 0.0 113.28 -174.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.9 p -87.61 -167.74 1.99 Allowed 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 118.912 0.778 . . . . 0.0 110.324 -175.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 15.5 mmp_? -103.38 -43.31 5.46 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.72 0.808 . . . . 0.0 110.169 161.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.15 -22.65 67.02 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -175.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -65.08 -24.89 67.58 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 120.355 1.434 . . . . 0.0 110.981 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -65.9 -7.45 16.64 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 121.458 -0.776 . . . . 0.0 111.938 174.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.91 -75.86 0.24 Allowed 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 157.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -55.17 -55.6 29.38 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 113.736 1.014 . . . . 0.0 113.736 -166.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 57.8 t -58.83 -54.08 38.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 124.569 1.148 . . . . 0.0 109.754 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.27 -26.1 67.54 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -74.25 -42.56 59.46 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 125.036 1.335 . . . . 0.0 110.393 176.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -57.25 -41.7 80.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.252 0.621 . . . . 0.0 110.205 172.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 25.7 t -70.88 -30.12 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 O-C-N 121.175 -0.953 . . . . 0.0 111.126 177.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -77.54 -15.56 59.19 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.762 0.825 . . . . 0.0 112.596 175.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -105.92 7.2 41.22 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.919 1.723 . . . . 0.0 112.376 -172.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.91 146.69 27.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.563 1.182 . . . . 0.0 110.054 -172.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 12.7 mtt-85 -111.54 155.45 23.27 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 126.98 2.112 . . . . 0.0 109.427 -173.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.3 m -131.51 23.56 4.74 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 122.145 0.974 . . . . 0.0 110.744 -176.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 . . . . . 0 C--O 1.251 1.16 0 C-N-CA 128.696 2.799 . . . . 0.0 112.243 161.161 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 . . . . . 0 CA--C 1.534 0.347 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.8 p -135.6 166.97 21.99 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 177.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -57.44 -36.79 71.83 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.844 0.458 . . . . 0.0 110.618 -176.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -49.5 74.77 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.92 1.288 . . . . 0.0 110.858 178.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -58.56 -39.77 81.2 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.204 1.002 . . . . 0.0 109.69 -175.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 85.9 mt -72.17 -36.49 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 C-N-CA 124.856 1.262 . . . . 0.0 109.809 -176.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -57.01 -33.72 64.53 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 123.653 0.644 . . . . 0.0 112.813 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.06 -55.8 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 118.146 0.973 . . . . 0.0 109.193 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.92 -42.22 75.75 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.98 0.912 . . . . 0.0 111.772 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.45 -51.05 69.88 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.35 1.86 . . . . 0.0 110.799 173.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.52 -25.65 75.3 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 123.264 0.459 . . . . 0.0 112.678 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 74.2 mt -67.49 -20.29 65.44 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 119.575 1.688 . . . . 0.0 112.412 176.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -81.48 -17.39 48.82 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.637 -0.664 . . . . 0.0 112.702 169.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.9 mm -142.95 101.1 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 N-CA-C 106.519 -1.659 . . . . 0.0 106.519 -158.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.2 m 55.8 54.47 9.07 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 123.295 0.638 . . . . 0.0 112.599 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.64 -40.64 44.92 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.121 2.548 . . . . 0.0 111.028 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -65.43 -47.78 75.04 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.774 -0.579 . . . . 0.0 110.29 -170.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -48.23 -45.88 34.75 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.61 1.964 . . . . 0.0 110.396 170.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.493 HD12 ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -67.16 -46.29 74.47 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -166.229 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -62.91 -37.73 88.15 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 117.05 -1.452 . . . . 0.0 111.552 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -59.22 -48.43 81.65 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 120.231 1.378 . . . . 0.0 108.989 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -64.9 -40.93 95.86 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 118.433 -0.794 . . . . 0.0 111.001 -172.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.9 mm -63.72 -44.81 98.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 119.284 0.947 . . . . 0.0 110.556 173.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.94 -11.25 26.64 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -116.51 7.6 13.77 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.297 1.439 . . . . 0.0 112.008 174.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 46.12 34.38 2.07 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.295 2.638 . . . . 0.0 112.969 -175.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -82.66 -13.54 56.26 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.7 1.6 . . . . 0.0 113.863 -177.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.6 tp -93.71 123.62 37.17 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.584 -0.698 . . . . 0.0 110.228 -156.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 79.0 t -104.36 140.71 21.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 124.541 1.136 . . . . 0.0 108.176 173.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -108.36 151.35 26.13 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 129.141 2.976 . . . . 0.0 106.841 169.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -165.4 173.9 41.17 Favored Glycine 0 N--CA 1.451 -0.306 0 O-C-N 121.517 -0.74 . . . . 0.0 111.658 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -107.8 143.37 18.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 163.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.726 HG13 HG11 ' A' ' 61' ' ' VAL . 27.2 t -48.5 -60.82 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 125.73 1.612 . . . . 0.0 113.703 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.2 mttt 60.63 165.92 0.09 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.866 1.666 . . . . 0.0 113.262 -170.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -72.7 -7.43 20.78 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.14 1.894 . . . . 0.0 112.514 171.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 m -70.04 -34.85 73.77 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.584 0.754 . . . . 0.0 112.437 -177.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -107.17 167.59 9.8 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 119.005 0.82 . . . . 0.0 112.163 -160.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.9 m -89.17 103.82 16.41 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.071 0.948 . . . . 0.0 109.555 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.726 HG11 HG13 ' A' ' 55' ' ' VAL . 28.9 m -140.45 156.58 69.47 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 123.602 0.761 . . . . 0.0 111.899 -164.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -71.84 179.28 4.93 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.649 2.233 . . . . 0.0 110.149 172.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.9 162.76 27.84 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.741 0.816 . . . . 0.0 110.228 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.8 13.56 82.99 Favored Glycine 0 CA--C 1.529 0.918 0 CA-C-O 118.907 -0.941 . . . . 0.0 113.376 171.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.659 ' O ' HG11 ' A' ' 55' ' ' VAL . 12.7 m -146.38 75.03 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 C-N-CA 125.685 1.594 . . . . 0.0 108.956 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.53 -15.29 33.28 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 119.964 -1.71 . . . . 0.0 113.183 173.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -150.81 5.72 0.51 Allowed 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 125.528 1.531 . . . . 0.0 110.933 -161.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -69.42 144.33 53.37 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 167.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.5 m -71.01 163.26 27.94 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.309 163.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -142.46 166.95 23.26 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.994 0.918 . . . . 0.0 111.118 169.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 20.4 mt -142.15 134.48 27.83 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 127.338 2.255 . . . . 0.0 107.55 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.6 p -160.95 157.64 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 125.992 1.717 . . . . 0.0 106.648 -171.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.465 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -77.0 157.39 31.22 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.022 -1.049 . . . . 0.0 109.022 167.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.07 -11.35 60.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 118.149 -0.929 . . . . 0.0 112.78 169.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -136.49 21.74 3.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.623 1.569 . . . . 0.0 110.896 -171.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.465 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 33.4 m-20 -140.71 43.98 1.83 Allowed 'General case' 0 N--CA 1.471 0.624 0 O-C-N 120.321 -1.487 . . . . 0.0 107.785 172.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.89 -48.33 80.96 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.1 -1.0 . . . . 0.0 110.654 -172.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -76.05 -3.67 37.1 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.48 -98.21 0.8 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.162 0.887 . . . . 0.0 112.166 -173.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 19.4 m -104.79 151.06 24.23 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.487 -1.008 . . . . 0.0 109.405 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.8 tt -153.83 154.41 7.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-N 119.256 0.934 . . . . 0.0 109.339 165.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 53.6 mt -130.25 127.05 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 171.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -102.67 155.79 18.07 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.03 1.332 . . . . 0.0 107.919 168.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 7.0 p90 -161.15 153.89 20.77 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 120.913 -1.117 . . . . 0.0 109.757 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.0 tttt -142.38 119.96 11.76 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 172.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.48 140.66 32.19 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.036 0.835 . . . . 0.0 109.077 169.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -134.72 84.09 2.08 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.212 1.805 . . . . 0.0 108.075 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 73.63 -49.06 1.63 Allowed Glycine 0 CA--C 1.529 0.956 0 C-N-CA 125.969 1.747 . . . . 0.0 113.237 175.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.405 ' O ' ' HG ' ' A' ' 110' ' ' LEU . 48.9 mt-30 -142.06 -43.51 0.34 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.96 2.104 . . . . 0.0 110.308 166.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 4.4 m -78.75 126.21 30.41 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 120.226 -1.546 . . . . 0.0 109.719 -165.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 23.8 t -105.65 113.39 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.1 mp -83.32 95.19 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 169.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.5 mt -76.55 117.51 21.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 172.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -113.08 83.7 1.87 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.467 1.907 . . . . 0.0 107.865 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -102.3 166.91 10.31 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 120.396 -1.44 . . . . 0.0 110.837 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 13.7 t -136.06 177.88 7.49 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 169.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.8 p -128.31 -3.07 5.6 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 126.228 1.811 . . . . 0.0 110.683 171.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -147.24 142.46 27.24 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 157.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 39.1 mmm-85 -57.74 -34.26 69.33 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.504 0.721 . . . . 0.0 112.834 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.76 13.6 0.62 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -179.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.0 p -132.92 158.89 41.47 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 119.482 1.037 . . . . 0.0 110.401 171.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.54 174.24 1.04 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-O 122.253 1.025 . . . . 0.0 110.968 171.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -83.66 149.57 26.43 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.653 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -177.39 0.39 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.224 1.81 . . . . 0.0 108.35 156.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -154.14 94.6 1.75 Allowed 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.006 -1.059 . . . . 0.0 111.558 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.7 tptt -101.43 119.98 39.59 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 173.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -114.44 123.42 49.39 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.922 1.289 . . . . 0.0 109.014 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 24.7 mt -142.84 141.42 31.59 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.322 1.049 . . . . 0.0 109.299 -168.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 p -78.78 148.71 32.85 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 120.411 1.459 . . . . 0.0 111.62 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 89' ' ' GLN . 9.7 mt -56.44 -30.82 63.32 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 120.855 -1.153 . . . . 0.0 111.937 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -46.92 77.46 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 124.257 1.023 . . . . 0.0 110.981 177.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -55.07 -59.56 4.59 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.575 -1.202 . . . . 0.0 108.99 168.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -48.09 -45.21 32.4 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.423 1.01 . . . . 0.0 111.538 -176.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -69.96 -30.94 68.42 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.47 0.708 . . . . 0.0 111.834 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -65.89 0.63 Allowed 'General case' 0 C--N 1.323 -0.548 0 O-C-N 120.758 -1.214 . . . . 0.0 107.873 169.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -44.54 -51.61 8.75 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.535 2.334 . . . . 0.0 110.311 -172.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -125.18 13.25 8.32 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.132 0.973 . . . . 0.0 111.932 -166.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -136.44 15.52 3.19 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 119.985 1.266 . . . . 0.0 112.375 172.611 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.521 HE21 ' NE2' ' A' ' 123' ' ' GLN 0.261 0.2 OUTLIER -62.11 -45.12 94.87 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 178.725 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.35 -176.11 2.13 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 119.934 1.243 . . . . 0.0 110.579 -164.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -25.02 39.16 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 119.197 -2.189 . . . . 0.0 111.29 170.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.35 -22.13 28.6 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 125.139 1.376 . . . . 0.0 109.563 -166.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.521 ' NE2' HE21 ' A' ' 119' ' ' GLN . 2.3 mm-40 -54.94 -33.53 62.35 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.994 0.918 . . . . 0.0 110.644 173.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.84 -3.42 2.43 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.968 1.707 . . . . 0.0 113.109 178.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.06 -2.41 2.56 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 128.35 2.66 . . . . 0.0 111.903 -175.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -112.08 -70.18 0.82 Allowed 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 124.974 1.309 . . . . 0.0 108.174 174.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.6 t -49.33 -58.26 1.43 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 C-N-CA 124.915 1.286 . . . . 0.0 108.901 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -18.46 58.17 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -179.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -85.08 -43.23 14.08 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 125.84 1.656 . . . . 0.0 111.275 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -62.93 -34.49 77.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.25 0.62 . . . . 0.0 110.298 177.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 17.2 t -66.04 -16.73 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.051 -1.031 . . . . 0.0 111.167 173.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -106.58 2.48 26.1 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.408 1.483 . . . . 0.0 111.902 176.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -114.56 -6.68 19.33 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.474 1.035 . . . . 0.0 112.692 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -80.05 169.9 17.2 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.541 1.17 . . . . 0.0 110.229 173.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -124.5 162.56 23.72 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.635 1.974 . . . . 0.0 106.898 175.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.4 m -132.75 11.18 4.36 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.581 0.628 . . . . 0.0 111.807 -175.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 C--O 1.252 1.207 0 C-N-CA 124.208 1.003 . . . . 0.0 108.404 -157.321 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 CA--C 1.54 0.584 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.1 p -88.13 159.87 18.02 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 173.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -48.54 -47.8 39.01 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.864 0.866 . . . . 0.0 110.488 173.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -55.08 32.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.867 0.867 . . . . 0.0 110.374 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -58.97 -43.87 91.43 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.734 1.613 . . . . 0.0 110.396 -173.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 85.1 mt -60.89 -45.27 98.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 125.521 1.528 . . . . 0.0 108.592 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -61.74 -35.12 90.76 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 124.206 0.907 . . . . 0.0 112.908 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.405 HG21 HG22 ' A' ' 131' ' ' VAL . 93.4 t -66.23 -51.8 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.107 0 CA-C-N 118.161 0.981 . . . . 0.0 108.634 177.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.35 -40.52 97.51 Favored 'General case' 0 CA--C 1.522 -0.097 0 O-C-N 121.947 -0.471 . . . . 0.0 111.661 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.17 -34.56 76.65 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.469 -0.3 . . . . 0.0 110.576 175.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.22 -28.65 57.8 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.16 -27.08 69.12 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.059 1.429 . . . . 0.0 111.247 170.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.432 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -74.13 -21.67 59.77 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.118 -0.988 . . . . 0.0 111.939 174.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.432 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.7 mp -131.07 91.92 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 125.558 1.543 . . . . 0.0 108.755 -171.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.18 67.5 0.92 Allowed Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.426 1.49 . . . . 0.0 110.041 -178.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -64.25 -33.19 60.72 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.716 2.277 . . . . 0.0 111.528 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -65.16 -48.02 74.99 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 117.56 -1.209 . . . . 0.0 110.32 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -48.7 -61.49 2.01 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.651 0.78 . . . . 0.0 109.912 168.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.419 HD22 HD11 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -45.45 -58.27 3.48 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.137 1.775 . . . . 0.0 109.94 -177.413 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -63.07 -44.58 95.4 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.787 1.235 . . . . 0.0 111.651 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -62.06 -32.88 73.45 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 119.372 0.987 . . . . 0.0 111.08 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -65.59 -50.34 65.46 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 41.8 mm -60.18 -36.59 69.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 118.518 0.599 . . . . 0.0 111.203 177.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.34 -12.42 21.0 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 118.675 0.67 . . . . 0.0 112.693 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.62 19.8 7.28 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.204 1.802 . . . . 0.0 111.761 172.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 51.71 23.77 2.13 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 127.747 2.419 . . . . 0.0 113.164 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -78.68 -26.45 45.0 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.785 1.234 . . . . 0.0 113.624 -165.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.419 HD11 HD22 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -76.81 145.11 38.67 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.473 1.509 . . . . 0.0 109.69 -157.608 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 22.0 t -124.31 158.39 31.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 126.453 1.901 . . . . 0.0 108.612 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -124.14 143.11 50.67 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 127.055 2.142 . . . . 0.0 106.571 165.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -149.15 163.97 29.22 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 110.252 -1.139 . . . . 0.0 110.252 169.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 20.1 mm -93.29 144.21 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 105.281 -2.118 . . . . 0.0 105.281 157.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 68' ' ' TYR . 28.1 t -45.18 -68.13 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 126.454 1.902 . . . . 0.0 112.394 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.7 mttt 59.76 150.75 0.09 OUTLIER Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 130.342 3.457 . . . . 0.0 113.178 -165.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -77.74 -16.35 14.72 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.172 1.915 . . . . 0.0 113.335 -170.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -69.25 -3.59 14.4 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.35 -0.844 . . . . 0.0 112.84 175.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -115.55 172.59 7.02 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.574 1.55 . . . . 0.0 108.593 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.9 m -108.9 123.94 49.86 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 -168.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.535 HG11 HG13 ' A' ' 55' ' ' VAL . 0.6 OUTLIER -142.64 155.82 63.36 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.025 0.93 . . . . 0.0 111.374 -170.283 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.536 ' HG2' HD21 ' A' ' 103' ' ' LEU . 8.2 Cg_endo -65.93 172.99 7.63 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.563 2.842 . . . . 0.0 111.171 164.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.15 139.81 44.76 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 121.323 -0.861 . . . . 0.0 111.861 -178.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.54 54.45 3.72 Favored Glycine 0 CA--C 1.488 -1.638 0 C-N-CA 126.201 1.858 . . . . 0.0 113.848 172.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.805 HG23 ' HB2' ' A' ' 68' ' ' TYR . 1.6 p 176.35 71.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 -169.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.9 -16.12 13.93 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.599 1.159 . . . . 0.0 111.27 176.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -145.2 12.71 1.39 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.406 2.282 . . . . 0.0 110.321 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.805 ' HB2' HG23 ' A' ' 65' ' ' VAL . 4.1 m-85 -62.21 147.42 47.89 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 168.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.4 m -71.9 159.94 33.4 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 163.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -140.55 155.84 46.48 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.4 1.08 . . . . 0.0 109.982 165.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -117.9 133.76 55.61 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 167.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.6 p -149.83 164.94 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.884 1.674 . . . . 0.0 106.783 169.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.432 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -98.31 149.66 22.38 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 119.982 1.264 . . . . 0.0 108.381 171.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.82 -18.69 64.37 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -172.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -136.04 26.43 3.27 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.535 2.334 . . . . 0.0 109.024 -175.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.432 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 25.7 t70 -128.88 39.22 3.83 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 128.138 2.575 . . . . 0.0 105.417 159.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -67.41 -50.3 60.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 127.159 2.184 . . . . 0.0 110.778 -161.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -96.84 39.88 1.16 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.539 1.536 . . . . 0.0 107.664 167.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -116.59 -126.08 3.82 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 126.247 1.879 . . . . 0.0 110.146 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.53 136.18 33.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 117.427 0.614 . . . . 0.0 109.976 -172.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.1 tt -140.19 151.09 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-O 121.585 0.707 . . . . 0.0 109.782 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.528 HG23 ' HB3' ' A' ' 95' ' ' TYR . 7.8 mt -134.9 108.72 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -77.08 152.98 34.79 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.155 0.889 . . . . 0.0 109.552 167.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.0 p90 -152.86 164.91 36.98 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.313 -1.492 . . . . 0.0 109.825 166.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -148.55 138.04 21.99 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 158.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -74.98 151.24 38.83 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 162.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -138.46 13.54 2.77 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.342 1.857 . . . . 0.0 111.444 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 103.5 100.84 2.61 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 108.79 -1.724 . . . . 0.0 108.79 -178.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 49.6 12.92 0.07 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.576 1.95 . . . . 0.0 115.097 -171.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.68 148.37 39.0 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.892 1.277 . . . . 0.0 107.688 -174.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 60.1 t -135.45 114.72 16.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 125.377 1.471 . . . . 0.0 107.743 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.46 HD12 ' H ' ' A' ' 92' ' ' ILE . 3.9 mp -79.38 101.23 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 167.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mt -79.65 113.11 18.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 169.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.437 ' HD2' ' CE2' ' A' ' 68' ' ' TYR . 13.0 mttt -109.76 100.41 9.42 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -178.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.528 ' HB3' HG23 ' A' ' 82' ' ' ILE . 43.6 p90 -124.7 174.18 8.05 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 121.548 -0.72 . . . . 0.0 110.869 -171.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.425 HG23 ' O ' ' A' ' 98' ' ' GLN . 1.5 t -169.42 164.72 10.64 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -173.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -13.38 60.52 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.076 0.95 . . . . 0.0 112.896 166.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.425 ' O ' HG23 ' A' ' 96' ' ' THR . 2.1 tt0 -135.56 -170.6 2.64 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.12 0.968 . . . . 0.0 110.754 -162.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.52 -70.38 0.8 Allowed 'General case' 0 CA--C 1.503 -0.839 0 C-N-CA 125.48 1.512 . . . . 0.0 109.798 -173.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -77.23 51.31 0.83 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.644 0.778 . . . . 0.0 112.554 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.1 p -141.81 165.51 27.28 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 119.734 -1.854 . . . . 0.0 111.283 176.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.04 161.55 24.14 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.599 -0.688 . . . . 0.0 110.734 174.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.536 HD21 ' HG2' ' A' ' 62' ' ' PRO . 1.2 mm? -114.42 160.43 19.18 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.877 1.271 . . . . 0.0 109.966 -163.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -73.96 177.16 5.82 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.511 0.724 . . . . 0.0 109.217 162.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.02 51.4 1.31 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.304 1.041 . . . . 0.0 112.043 -171.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.571 ' HE3' HD21 ' A' ' 108' ' ' LEU . 31.3 tptt -65.56 120.14 12.37 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 106.314 -1.735 . . . . 0.0 106.314 173.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -122.18 93.12 3.89 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 119.883 1.22 . . . . 0.0 108.361 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.571 HD21 ' HE3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -95.92 159.75 14.81 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 123.941 0.896 . . . . 0.0 108.722 178.296 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 68.6 p -73.96 155.2 38.89 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.625 167.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 28.3 mt -57.57 -39.12 76.02 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 120.361 -1.462 . . . . 0.0 109.405 166.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 t -63.54 -34.12 77.09 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 124.139 0.976 . . . . 0.0 111.195 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.66 -69.18 0.13 Allowed 'General case' 0 C--N 1.345 0.391 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 168.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -53.66 -35.26 60.83 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.255 0.622 . . . . 0.0 112.407 -169.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 7.9 tmtm? -62.28 -58.23 8.49 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 118.082 0.401 . . . . 0.0 110.695 173.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.87 -30.48 70.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.703 -170.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.3 -85.36 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.809 2.444 . . . . 0.0 108.023 170.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -90.03 -16.02 30.62 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -161.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -115.06 45.39 1.63 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.146 0.979 . . . . 0.0 110.156 -167.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.72 -37.48 27.24 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -164.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . 0.314 0.1 OUTLIER -101.17 -164.42 1.11 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.375 1.07 . . . . 0.0 109.968 -173.195 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.92 -22.47 16.3 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.959 1.704 . . . . 0.0 111.971 162.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 35.7 p -80.42 -31.17 37.67 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 117.619 -1.182 . . . . 0.0 110.841 -173.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -61.44 -30.09 70.36 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.397 1.453 . . . . 0.0 110.771 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 12.2 mtpt -52.8 -34.81 55.33 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 118.838 -0.601 . . . . 0.0 109.731 -178.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.47 -26.33 65.16 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.119 -0.943 . . . . 0.0 112.806 -178.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -99.86 -51.61 3.67 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 118.495 0.589 . . . . 0.0 110.065 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.3 t -59.26 -48.44 86.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 O-C-N 121.703 -0.623 . . . . 0.0 110.368 -174.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -61.98 -36.96 83.05 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 121.81 -0.556 . . . . 0.0 111.794 175.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -62.32 -42.8 99.68 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.223 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -58.91 -39.35 81.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.211 1.005 . . . . 0.0 110.306 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.405 HG22 HG21 ' A' ' 30' ' ' VAL . 97.8 t -68.95 -33.08 57.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 O-C-N 121.694 -0.629 . . . . 0.0 111.236 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -86.38 -16.28 37.8 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.128 0.877 . . . . 0.0 111.712 174.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.39 -46.29 6.56 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 125.72 1.629 . . . . 0.0 110.787 -178.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.1 pp -55.29 142.44 31.84 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.45 0.643 . . . . 0.0 109.805 176.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.26 171.68 11.73 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.801 1.641 . . . . 0.0 110.103 172.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.76 -5.48 11.57 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.876 0.87 . . . . 0.0 111.782 171.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 . . . . . 0 C--O 1.24 0.567 0 C-N-CA 130.919 3.688 . . . . 0.0 107.098 175.435 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 . . . . . 0 CA--C 1.538 0.512 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 p -126.53 149.27 49.48 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.251 1.42 . . . . 0.0 107.666 164.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -66.11 -23.89 66.59 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.602 1.161 . . . . 0.0 111.424 -169.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -56.65 -48.88 76.58 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.284 2.233 . . . . 0.0 109.798 170.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -67.72 -36.02 79.84 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.726 1.61 . . . . 0.0 110.742 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 97.6 mt -69.8 -42.84 80.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 C-N-CA 123.975 0.91 . . . . 0.0 111.037 -172.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -65.06 -29.93 76.65 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 119.062 0.847 . . . . 0.0 112.152 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.6 t -62.65 -56.73 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 171.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.4 mp -56.58 -40.36 75.11 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.706 0.802 . . . . 0.0 112.169 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.54 69.69 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.9 0.773 . . . . 0.0 111.069 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.05 -21.88 79.5 Favored Glycine 0 CA--C 1.533 1.168 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 mp -66.06 -22.45 66.42 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 120.268 -1.725 . . . . 0.0 112.116 170.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.85 -18.43 32.88 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.103 -0.951 . . . . 0.0 113.078 173.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -132.71 94.99 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -176.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 59.33 70.52 1.09 Allowed Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 126.698 1.999 . . . . 0.0 111.741 -174.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -56.94 -45.42 36.35 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 122.206 1.937 . . . . 0.0 110.584 173.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.43 -46.21 80.37 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.63 0.772 . . . . 0.0 112.091 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -57.18 -49.33 76.31 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 119.04 0.836 . . . . 0.0 109.559 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.0 tt -55.15 -58.2 8.65 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.8 mtpt -55.48 -39.97 71.09 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.544 1.138 . . . . 0.0 110.97 -174.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -67.6 -48.33 67.11 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 118.317 0.508 . . . . 0.0 111.019 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -66.26 -29.24 69.44 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.818 -176.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.4 mm -64.61 -45.39 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 119.706 1.139 . . . . 0.0 109.764 169.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.83 -10.06 34.53 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.972 -1.08 . . . . 0.0 112.759 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.86 -4.7 25.83 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.334 1.453 . . . . 0.0 112.991 171.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 46.1 39.8 6.36 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.329 1.452 . . . . 0.0 110.496 -167.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.68 -13.44 15.57 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.303 1.441 . . . . 0.0 112.373 -177.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.8 134.52 34.31 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.036 0.934 . . . . 0.0 108.93 -167.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.6 t -117.23 164.79 13.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 125.704 1.602 . . . . 0.0 109.232 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -144.21 110.56 5.51 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 129.698 3.199 . . . . 0.0 103.214 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.51 170.8 24.6 Favored Glycine 0 CA--C 1.518 0.253 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 170.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 42.2 mm -99.96 143.53 13.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -175.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.594 HG13 HG11 ' A' ' 61' ' ' VAL . 24.9 t -51.18 -60.43 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 C-N-CA 124.98 1.312 . . . . 0.0 111.538 174.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.5 mttt 60.14 165.69 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 125.361 1.464 . . . . 0.0 113.909 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -63.92 -25.83 67.02 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.865 1.71 . . . . 0.0 112.743 170.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 30.4 m -86.75 2.7 47.85 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -164.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -125.14 160.78 28.33 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 119.69 1.132 . . . . 0.0 110.548 -170.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.0 m -89.3 114.89 26.33 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.655 0.782 . . . . 0.0 109.101 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.594 HG11 HG13 ' A' ' 55' ' ' VAL . 6.0 m -143.04 165.24 27.16 Favored Pre-proline 0 C--O 1.237 0.436 0 O-C-N 121.369 -0.832 . . . . 0.0 112.428 -170.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.42 ' CG ' HD21 ' A' ' 103' ' ' LEU . 34.6 Cg_endo -66.89 165.0 27.49 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.136 2.557 . . . . 0.0 111.495 168.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.49 137.92 54.81 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 121.835 -0.54 . . . . 0.0 110.562 174.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.0 25.22 11.55 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-O 118.756 -1.024 . . . . 0.0 114.783 161.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.6 m -136.54 29.58 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 124.515 1.126 . . . . 0.0 110.883 -174.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -58.16 -16.27 12.83 Favored 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 117.584 2.439 . . . . 0.0 117.584 -153.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -156.2 32.56 0.33 Allowed 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 127.465 2.306 . . . . 0.0 108.985 172.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -69.4 155.91 39.68 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 167.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.67 153.8 36.94 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 161.058 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -136.81 149.49 47.78 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.724 0.809 . . . . 0.0 109.828 164.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.91 127.17 54.78 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 175.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -145.56 159.6 12.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 171.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.537 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -85.84 159.43 19.71 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 169.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.86 -18.78 57.98 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -122.95 7.69 9.29 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.75 1.62 . . . . 0.0 112.539 -173.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.537 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 14.2 t70 -110.38 21.18 16.98 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.0 0.92 . . . . 0.0 111.16 -174.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -49.08 -44.32 41.88 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 128.054 2.542 . . . . 0.0 113.096 -167.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -103.57 -8.81 19.75 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.967 0.907 . . . . 0.0 111.948 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.3 -69.36 1.4 Allowed Glycine 0 C--N 1.334 0.467 0 C-N-CA 125.73 1.633 . . . . 0.0 110.36 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.59 161.83 36.96 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.895 0.847 . . . . 0.0 110.815 -170.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tt -163.18 152.23 3.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 171.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.7 mt -133.36 143.67 38.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 168.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -118.5 149.91 40.5 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.826 1.651 . . . . 0.0 108.194 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -147.35 159.99 43.04 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.047 1.294 . . . . 0.0 111.87 171.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.0 tttm -154.85 110.59 3.14 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.173 0.589 . . . . 0.0 110.692 167.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.42 108.73 2.06 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 127.992 2.517 . . . . 0.0 112.87 172.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -121.45 97.58 5.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.726 1.21 . . . . 0.0 111.345 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 48.92 77.43 0.12 Allowed Glycine 0 CA--C 1.522 0.509 0 C-N-CA 124.317 0.961 . . . . 0.0 113.199 174.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 68.43 -86.56 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.503 1.921 . . . . 0.0 107.906 -155.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.2 m -64.11 131.63 48.08 Favored 'General case' 0 C--N 1.314 -0.962 0 C-N-CA 125.043 1.337 . . . . 0.0 113.769 -157.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 107' ' ' ALA . 2.8 m -101.05 114.6 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 O-C-N 121.089 -1.007 . . . . 0.0 111.424 -179.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.504 HD12 ' H ' ' A' ' 92' ' ' ILE . 4.3 mp -72.6 100.59 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 172.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.413 ' CD1' HD23 ' A' ' 108' ' ' LEU . 16.8 mt -81.08 139.76 17.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 167.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -129.7 112.53 13.74 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.273 1.429 . . . . 0.0 107.484 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.3 p90 -137.55 167.43 21.68 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 120.854 -1.154 . . . . 0.0 110.533 -168.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -153.48 170.86 19.71 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.681 0.753 . . . . 0.0 109.258 -173.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.88 0.6 13.8 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.257 1.023 . . . . 0.0 110.827 169.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -143.87 153.45 42.35 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 124.108 0.963 . . . . 0.0 111.557 168.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -77.78 1.96 18.58 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 121.421 -0.8 . . . . 0.0 112.409 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.58 1.45 14.27 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.038 1.495 . . . . 0.0 115.038 -174.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.6 p -120.04 173.09 7.29 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.722 0.809 . . . . 0.0 112.544 -165.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.7 tptt -71.26 132.1 44.45 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.597 0.759 . . . . 0.0 109.924 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.443 ' H ' HD22 ' A' ' 103' ' ' LEU . 1.9 mm? -64.18 132.29 49.96 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.243 0.544 . . . . 0.0 109.562 170.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -67.1 175.43 2.59 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 125.358 1.463 . . . . 0.0 109.425 164.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -124.48 153.07 42.56 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.895 1.278 . . . . 0.0 110.007 176.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.459 ' CD ' HD21 ' A' ' 108' ' ' LEU . 0.4 OUTLIER -165.3 109.63 0.87 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 127.567 2.347 . . . . 0.0 104.773 168.021 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.414 ' HA ' ' O ' ' A' ' 91' ' ' VAL . . . -97.05 121.5 39.01 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 115.412 -2.232 . . . . 0.0 108.073 -171.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.459 HD21 ' CD ' ' A' ' 106' ' ' LYS . 3.4 mm? -119.64 121.97 40.48 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 122.869 2.577 . . . . 0.0 110.782 -171.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.9 p -59.17 143.97 47.3 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.299 0.571 . . . . 0.0 109.946 176.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 29.3 mt -52.31 -31.58 33.69 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.612 -1.305 . . . . 0.0 112.166 171.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.1 t -64.05 -43.36 95.72 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 117.169 -1.396 . . . . 0.0 111.819 174.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -51.88 -65.58 0.53 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-N 119.57 1.077 . . . . 0.0 109.512 173.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -56.9 -34.23 67.7 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.354 0.525 . . . . 0.0 111.647 -169.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 ttmp? -70.71 -40.16 73.0 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 118.689 -0.672 . . . . 0.0 110.53 -177.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -59.15 3.95 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 173.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -47.46 -50.81 22.09 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 124.184 0.928 . . . . 0.0 111.978 -173.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -130.55 14.65 5.47 Favored 'General case' 0 C--O 1.226 -0.182 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -165.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -149.69 22.83 0.9 Allowed 'General case' 0 C--O 1.239 0.54 0 O-C-N 120.521 -1.362 . . . . 0.0 113.157 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.416 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -55.51 -29.04 58.13 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.094 1.758 . . . . 0.0 113.846 -176.662 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.417 HG23 ' H ' ' A' ' 123' ' ' GLN . 9.6 t -135.7 159.9 40.19 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.069 1.348 . . . . 0.0 111.052 -169.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -71.08 -33.02 69.81 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.867 176.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.57 -37.83 88.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 119.686 1.13 . . . . 0.0 109.918 -176.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.417 ' H ' HG23 ' A' ' 120' ' ' THR . 10.3 tt0 -63.27 -19.27 64.42 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.661 1.185 . . . . 0.0 112.955 175.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -55.72 -32.91 63.76 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 117.836 -1.078 . . . . 0.0 111.298 174.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -54.21 -59.19 5.0 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 124.039 0.837 . . . . 0.0 110.469 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.07 -47.04 39.29 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 123.35 0.66 . . . . 0.0 110.455 -168.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 58.1 t -56.4 -56.53 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -59.35 -31.09 68.88 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 118.529 -0.748 . . . . 0.0 113.014 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -67.68 -37.57 82.51 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 119.064 0.847 . . . . 0.0 111.187 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -61.64 -42.46 98.93 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.611 0.641 . . . . 0.0 109.595 171.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 15.4 t -63.1 -38.89 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 121.445 -0.784 . . . . 0.0 110.517 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -81.14 -18.87 44.9 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.824 0.85 . . . . 0.0 112.535 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -108.27 -5.59 32.31 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 125.531 1.539 . . . . 0.0 114.103 -177.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.6 pp -78.08 146.09 35.42 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 118.764 1.282 . . . . 0.0 108.953 170.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 2.7 mtp-105 -90.38 165.01 14.1 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 124.149 0.98 . . . . 0.0 108.978 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.0 m -121.69 6.07 9.99 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.696 0.798 . . . . 0.0 111.203 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . 0.331 7.8 pt-20 . . . . . 0 C--O 1.247 0.921 0 C-N-CA 129.47 3.108 . . . . 0.0 113.177 -162.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.3 p -93.57 165.58 12.67 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -56.36 -44.26 79.96 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.968 0.804 . . . . 0.0 110.211 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.36 -50.64 72.32 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.57 0.748 . . . . 0.0 110.03 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -59.01 -48.38 81.8 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.564 1.145 . . . . 0.0 109.708 -175.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.2 mt -65.5 -35.91 76.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -175.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -57.83 -36.6 80.62 Favored Glycine 0 C--N 1.338 0.654 0 CA-C-O 118.967 -0.907 . . . . 0.0 112.712 177.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 75.6 t -70.13 -46.45 72.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 118.176 0.988 . . . . 0.0 109.157 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 113' ' ' LEU . 3.1 mp -60.15 -46.31 90.09 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.398 1.079 . . . . 0.0 111.508 177.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.99 -48.66 64.31 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.676 1.19 . . . . 0.0 110.515 175.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.07 -30.36 77.53 Favored Glycine 0 C--N 1.337 0.623 0 CA-C-O 119.15 -0.806 . . . . 0.0 113.619 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 34' ' ' LEU . 68.3 mt -63.77 -22.59 66.98 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 119.698 1.749 . . . . 0.0 112.408 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.447 ' HB2' ' CE2' ' A' ' 117' ' ' PHE . . . -94.56 -16.39 23.3 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 118.526 -0.75 . . . . 0.0 112.272 174.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -126.59 94.64 2.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.0 65.88 2.22 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 125.417 1.487 . . . . 0.0 111.865 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.38 -44.17 48.65 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.067 2.511 . . . . 0.0 111.891 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -66.9 -38.74 86.81 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.971 0.908 . . . . 0.0 110.251 -173.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 75.7 t90 -55.66 -56.31 21.94 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.7 tt -54.86 -52.3 63.22 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.867 -0.52 . . . . 0.0 110.785 -178.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.7 mttm -56.24 -47.7 77.96 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.655 0.782 . . . . 0.0 111.65 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -66.07 -38.48 88.4 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 118.937 0.79 . . . . 0.0 110.15 -177.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -69.12 -42.04 76.58 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.648 0.658 . . . . 0.0 110.62 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 25.4 mm -57.62 -40.29 74.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 119.203 0.911 . . . . 0.0 110.645 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.86 -20.08 55.02 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -119.96 23.25 11.13 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 120.949 -1.095 . . . . 0.0 112.117 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.4 t30 45.18 35.41 1.7 Allowed 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.967 2.107 . . . . 0.0 110.748 -176.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -79.52 -12.66 59.86 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 121.28 -0.887 . . . . 0.0 109.799 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -107.77 123.55 48.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 119.144 0.884 . . . . 0.0 108.863 -156.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.478 HG12 HG13 ' A' ' 72' ' ' VAL . 3.5 p -111.11 142.98 21.9 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 C-N-CA 124.565 1.146 . . . . 0.0 109.427 -178.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -99.0 137.78 37.04 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 126.065 1.746 . . . . 0.0 106.703 163.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.06 178.64 30.83 Favored Glycine 0 CA--C 1.522 0.494 0 CA-C-N 119.349 0.977 . . . . 0.0 110.944 176.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 18.4 mm -115.07 146.59 19.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 125.557 1.543 . . . . 0.0 107.371 172.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.456 HG13 HG11 ' A' ' 61' ' ' VAL . 32.2 t -54.11 -75.49 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.253 1.273 0 C-N-CA 126.067 1.747 . . . . 0.0 110.935 171.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp 54.33 158.23 0.06 OUTLIER Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 129.291 3.036 . . . . 0.0 112.06 -156.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -70.87 -4.9 15.7 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 122.334 2.023 . . . . 0.0 111.526 167.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.4 m -67.98 3.55 1.52 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.53 1.932 . . . . 0.0 113.409 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -136.32 173.55 11.59 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.271 1.396 . . . . 0.0 110.668 -173.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 m -90.11 104.12 16.73 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.255 1.822 . . . . 0.0 108.118 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.456 HG11 HG13 ' A' ' 55' ' ' VAL . 4.0 m -150.44 154.39 35.66 Favored Pre-proline 0 C--O 1.238 0.488 0 O-C-N 121.894 -0.504 . . . . 0.0 111.625 -168.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.21 166.42 26.96 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.684 2.256 . . . . 0.0 110.954 175.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -76.79 146.93 37.55 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.477 0.711 . . . . 0.0 110.482 -174.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.01 32.53 44.16 Favored Glycine 0 CA--C 1.528 0.858 0 O-C-N 121.693 -0.629 . . . . 0.0 113.976 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.9 m -133.63 26.12 1.15 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-N 118.787 1.294 . . . . 0.0 109.806 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -61.05 -16.16 40.54 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -154.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -143.81 14.88 1.74 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 127.337 2.255 . . . . 0.0 111.516 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -66.27 146.29 54.78 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.52 161.98 29.76 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.159 163.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 21.4 p90 -135.55 172.25 13.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 125.23 1.412 . . . . 0.0 109.604 165.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.9 mt -130.91 135.84 48.04 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 106.181 -1.785 . . . . 0.0 106.181 168.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.478 HG13 HG12 ' A' ' 51' ' ' VAL . 3.7 p -149.19 152.64 11.82 Favored 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-N 120.431 1.469 . . . . 0.0 110.766 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.407 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -78.86 112.39 15.98 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 172.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.16 -9.66 18.14 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 129.565 3.146 . . . . 0.0 114.735 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -106.55 -39.33 5.89 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.478 0.711 . . . . 0.0 109.733 169.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 7.4 t0 -94.55 51.01 1.38 Allowed 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 -171.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -67.82 -2.67 7.63 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -166.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -124.45 14.35 8.86 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.194 1.798 . . . . 0.0 111.459 166.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -80.23 -88.09 0.55 Allowed Glycine 0 N--CA 1.448 -0.531 0 O-C-N 120.835 -1.165 . . . . 0.0 111.194 175.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.3 m -130.69 160.86 33.04 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 123.799 0.84 . . . . 0.0 109.291 -170.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.8 tt -154.25 153.79 7.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 169.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.47 HG23 ' HB3' ' A' ' 95' ' ' TYR . 8.7 mt -139.73 112.21 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 119.017 0.826 . . . . 0.0 109.503 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -86.34 154.7 21.02 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.22 0.918 . . . . 0.0 110.987 177.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.7 p90 -163.06 155.59 18.66 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.995 0.918 . . . . 0.0 109.682 172.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.7 tttt -143.25 113.45 7.27 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 123.976 0.91 . . . . 0.0 108.568 167.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -84.81 95.91 9.13 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -66.01 -2.69 4.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.371 0.669 . . . . 0.0 112.385 179.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 91.62 127.64 4.01 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 107.45 -2.26 . . . . 0.0 107.45 -178.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.41 ' H ' HD12 ' A' ' 110' ' ' LEU . 90.8 mm-40 52.9 -12.82 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.473 1.909 . . . . 0.0 115.364 -162.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 59.9 m -144.37 156.81 44.4 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 122.346 2.339 . . . . 0.0 109.604 175.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 107' ' ' ALA . 6.9 p -146.89 106.95 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 C-N-CA 124.892 1.277 . . . . 0.0 111.442 -175.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -78.47 108.27 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 176.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 27.0 mt -95.49 126.01 48.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 125.339 1.456 . . . . 0.0 108.258 174.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -123.81 101.73 7.43 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 126.071 1.749 . . . . 0.0 106.709 -173.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.47 ' HB3' HG23 ' A' ' 82' ' ' ILE . 27.6 p90 -116.96 166.49 12.12 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.161 -0.962 . . . . 0.0 111.746 -176.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -147.88 169.08 20.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.094 1.358 . . . . 0.0 109.339 173.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.7 p -108.98 -2.67 18.08 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.046 2.539 . . . . 0.0 111.171 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -135.38 131.8 36.78 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 124.407 1.083 . . . . 0.0 108.871 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -23.89 40.48 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -97.78 -0.03 46.03 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 116.354 1.983 . . . . 0.0 116.354 -167.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.7 p -116.48 167.16 11.3 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -165.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -72.5 152.96 41.6 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.486 -0.759 . . . . 0.0 109.408 176.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -87.9 162.75 16.74 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.77 0.828 . . . . 0.0 111.567 -167.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -73.44 -173.85 1.51 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.882 1.673 . . . . 0.0 108.989 166.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.0 93.91 2.56 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.081 0.952 . . . . 0.0 111.053 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.565 ' HE3' HD11 ' A' ' 108' ' ' LEU . 29.9 tptt -103.2 150.3 23.82 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 163.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.4 ' HA ' ' O ' ' A' ' 91' ' ' VAL . . . -140.88 125.82 18.23 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 115.708 -2.091 . . . . 0.0 107.159 175.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.565 HD11 ' HE3' ' A' ' 106' ' ' LYS . 1.1 mm? -121.8 158.63 28.44 Favored 'General case' 0 CA--C 1.499 -1.015 0 CA-C-N 122.114 2.233 . . . . 0.0 108.316 -177.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 68.7 p -74.08 156.56 37.31 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 119.891 1.223 . . . . 0.0 109.365 166.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.41 HD12 ' H ' ' A' ' 89' ' ' GLN . 34.5 mt -59.33 -36.1 75.06 Favored 'General case' 0 C--N 1.34 0.154 0 O-C-N 121.441 -0.787 . . . . 0.0 110.079 167.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.86 -36.44 82.32 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.799 -177.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.31 -59.05 4.64 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 124.062 0.945 . . . . 0.0 109.137 171.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.604 ' HB3' HD23 ' A' ' 31' ' ' LEU . 2.6 mm? -56.14 -40.03 73.17 Favored 'General case' 0 C--N 1.339 0.125 0 C-N-CA 123.09 0.556 . . . . 0.0 112.071 -175.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -63.58 -45.35 90.81 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 121.784 -0.573 . . . . 0.0 110.009 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -35.06 74.45 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.242 -0.409 . . . . 0.0 110.436 -177.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.46 -58.84 4.03 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.373 0.669 . . . . 0.0 109.241 177.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.447 ' CE2' ' HB2' ' A' ' 35' ' ' ALA . 6.6 m-85 -134.26 19.17 3.7 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -161.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.538 ' HB2' HD21 ' A' ' 31' ' ' LEU . 0.5 OUTLIER -141.01 66.34 1.37 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.268 1.395 . . . . 0.0 112.867 171.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -119.32 -25.54 6.07 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 -167.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.2 t -139.66 152.59 46.86 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 120.423 1.465 . . . . 0.0 108.644 -172.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -58.85 -30.51 67.76 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 119.916 -1.74 . . . . 0.0 113.202 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 65.5 m -53.05 -48.3 67.77 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 118.637 -0.697 . . . . 0.0 110.388 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.38 -33.03 64.81 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 117.169 -1.812 . . . . 0.0 107.88 -178.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 124' ' ' LYS . 35.2 mtpt -62.94 -3.39 1.6 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 114.22 1.193 . . . . 0.0 114.22 174.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -76.55 -81.89 0.08 Allowed 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 105.35 -2.093 . . . . 0.0 105.35 155.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.64 -49.57 76.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -163.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.48 ' HA ' ' CD2' ' A' ' 130' ' ' TYR . 38.3 t -56.86 -38.24 58.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 125.346 1.458 . . . . 0.0 110.722 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.62 -32.88 47.66 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.396 -0.815 . . . . 0.0 110.871 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -69.15 -31.38 70.0 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 120.899 -1.125 . . . . 0.0 111.461 175.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . 0.48 ' CD2' ' HA ' ' A' ' 127' ' ' VAL . 14.7 m-85 -63.06 -24.68 68.02 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 120.496 -1.378 . . . . 0.0 111.237 172.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 40.3 t -78.19 -11.99 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 122.942 0.497 . . . . 0.0 110.445 174.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -104.71 -17.01 14.79 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.423 1.089 . . . . 0.0 111.972 172.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -96.91 17.94 58.39 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 125.762 1.648 . . . . 0.0 113.026 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.0 pp -106.45 149.08 27.41 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 122.18 0.99 . . . . 0.0 110.275 177.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.409 ' HB3' HG23 ' A' ' 51' ' ' VAL . 5.1 mtt-85 -75.61 169.33 18.32 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.185 2.194 . . . . 0.0 107.83 163.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.22 -3.84 2.42 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.328 1.051 . . . . 0.0 113.014 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 C--O 1.245 0.847 0 C-N-CA 131.162 3.785 . . . . 0.0 107.145 177.196 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 . . . . . 0 CA--C 1.55 0.958 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -141.2 144.68 34.9 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 129.223 3.009 . . . . 0.0 106.438 174.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -53.01 -43.57 66.6 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 120.174 1.352 . . . . 0.0 110.531 -174.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.13 -54.22 7.09 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.065 1.746 . . . . 0.0 110.942 174.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.8 mm-40 -68.35 -36.9 79.93 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.675 1.19 . . . . 0.0 111.496 -177.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.402 HD13 ' HB3' ' A' ' 86' ' ' ALA . 97.9 mt -71.8 -39.92 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.066 0 C-N-CA 123.632 0.773 . . . . 0.0 109.39 -173.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.13 -35.55 92.13 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-N 118.828 0.74 . . . . 0.0 112.199 -175.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.6 -45.33 98.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 118.303 1.051 . . . . 0.0 109.534 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.62 -38.47 90.35 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.981 0.912 . . . . 0.0 110.711 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.95 -41.03 83.11 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.707 0.803 . . . . 0.0 111.188 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.71 -33.44 71.35 Favored Glycine 0 CA--C 1.528 0.87 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 176.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.57 -30.25 71.39 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 120.639 -1.507 . . . . 0.0 111.38 172.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.31 64.43 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 117.683 -1.151 . . . . 0.0 112.189 172.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -135.56 96.71 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 C-N-CA 125.375 1.47 . . . . 0.0 107.885 -165.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 60.98 67.41 1.46 Allowed Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.524 1.13 . . . . 0.0 109.762 -177.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -60.29 -33.88 94.18 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.734 2.289 . . . . 0.0 110.866 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -70.37 -39.64 74.48 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.66 -0.65 . . . . 0.0 111.955 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.1 t90 -56.97 -53.23 60.42 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.131 0.878 . . . . 0.0 108.859 174.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -46.4 -57.14 4.93 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.437 1.495 . . . . 0.0 109.329 173.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.1 mtpt -61.68 -41.08 97.08 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.464 1.106 . . . . 0.0 112.27 -175.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -67.55 -48.09 67.97 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.46 1.027 . . . . 0.0 109.562 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -42.03 81.05 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.801 0.441 . . . . 0.0 110.2 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.2 mm -60.52 -54.9 28.74 Favored 'Isoleucine or valine' 0 C--N 1.341 0.236 0 C-N-CA 124.438 1.095 . . . . 0.0 110.132 174.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.75 -42.85 65.33 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.352 0.661 . . . . 0.0 110.691 -175.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.23 -8.44 53.61 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 50.34 40.66 23.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.946 1.698 . . . . 0.0 110.979 -165.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -111.64 -5.57 14.48 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.871 0.868 . . . . 0.0 113.337 178.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.0 tp -73.63 128.7 36.21 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 119.172 0.896 . . . . 0.0 109.643 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.8 t -113.54 150.18 15.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 169.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -120.02 149.18 42.58 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 128.067 2.547 . . . . 0.0 106.908 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -163.7 177.21 39.64 Favored Glycine 0 N--CA 1.45 -0.413 0 N-CA-C 111.581 -0.607 . . . . 0.0 111.581 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.6 mm -106.45 149.24 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 125.375 1.47 . . . . 0.0 107.055 168.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.78 HG13 HG11 ' A' ' 61' ' ' VAL . 24.7 t -52.4 -86.02 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-O 116.866 -1.54 . . . . 0.0 110.627 172.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.408 ' N ' HG12 ' A' ' 55' ' ' VAL . 55.3 mmtt 55.44 164.99 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.925 0 CA-C-N 120.408 1.458 . . . . 0.0 112.956 -167.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -84.12 -3.36 10.29 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.36 2.707 . . . . 0.0 114.632 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.5 m -59.36 -24.16 63.16 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.369 1.068 . . . . 0.0 113.409 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.16 165.75 17.68 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 128.982 2.913 . . . . 0.0 108.103 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.4 t -65.64 146.69 54.5 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 121.781 -0.574 . . . . 0.0 109.568 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.78 HG11 HG13 ' A' ' 55' ' ' VAL . 1.9 m -153.55 162.36 26.82 Favored Pre-proline 0 C--O 1.237 0.413 0 C-N-CA 125.73 1.612 . . . . 0.0 108.865 174.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -75.71 167.82 25.59 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.798 2.332 . . . . 0.0 110.423 171.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.68 139.81 51.32 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 123.62 0.768 . . . . 0.0 109.996 171.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.54 39.45 5.01 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 125.797 1.665 . . . . 0.0 112.842 169.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.3 m -152.2 27.79 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 125.454 1.501 . . . . 0.0 111.143 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -65.75 -16.19 63.54 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -151.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -153.07 52.06 0.74 Allowed 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 128.547 2.739 . . . . 0.0 106.542 169.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -89.46 154.89 19.68 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 164.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.63 162.14 28.51 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 164.201 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -141.3 170.76 15.12 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.539 1.136 . . . . 0.0 109.757 166.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 18.7 mt -141.22 138.66 33.46 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 126.461 1.904 . . . . 0.0 107.176 174.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.516 HG21 HH21 ' A' ' 99' ' ' ARG . 10.8 p -162.4 155.82 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 125.636 1.574 . . . . 0.0 107.571 177.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.04 158.18 30.7 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 119.724 1.147 . . . . 0.0 108.97 170.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.26 -21.23 66.11 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 177.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -100.01 -32.01 11.17 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.11 0.964 . . . . 0.0 111.305 176.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.08 13.84 0.19 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.551 2.341 . . . . 0.0 112.076 -178.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.9 mm100 -59.5 -12.33 6.13 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.95 1.7 . . . . 0.0 113.793 -171.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.59 -2.83 9.36 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.923 0.889 . . . . 0.0 112.119 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.02 -87.92 1.72 Allowed Glycine 0 CA--C 1.526 0.764 0 C-N-CA 124.405 1.002 . . . . 0.0 112.483 -174.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 m -103.62 166.96 10.1 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.709 1.204 . . . . 0.0 109.298 -174.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.3 tt -166.65 151.24 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 124.64 1.176 . . . . 0.0 107.983 165.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.555 HG23 ' HB3' ' A' ' 95' ' ' TYR . 10.9 mt -134.6 99.19 2.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -78.6 153.04 31.46 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -157.9 158.96 36.04 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.491 -0.755 . . . . 0.0 109.333 167.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.435 ' HA ' ' HE3' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -143.02 106.89 4.66 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 167.805 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.402 ' HB3' HD13 ' A' ' 28' ' ' ILE . . . -82.69 147.61 28.39 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 168.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -147.57 -153.74 0.51 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 126.127 1.771 . . . . 0.0 107.911 -167.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.93 88.89 0.01 OUTLIER Glycine 0 CA--C 1.527 0.795 0 C-N-CA 125.815 1.674 . . . . 0.0 111.432 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 53.88 8.72 0.17 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.554 2.342 . . . . 0.0 115.491 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.6 m -125.35 163.48 22.49 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.554 1.942 . . . . 0.0 108.124 -175.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 7.7 p -151.19 106.37 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -0.99 0 C-N-CA 125.158 1.383 . . . . 0.0 111.865 174.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.457 HD12 ' H ' ' A' ' 92' ' ' ILE . 3.9 mp -74.41 96.65 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 172.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 15.3 mt -77.8 127.56 38.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 105.991 -1.855 . . . . 0.0 105.991 163.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -127.11 97.14 4.83 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 125.389 1.475 . . . . 0.0 107.343 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.555 ' HB3' HG23 ' A' ' 82' ' ' ILE . 47.7 p90 -124.03 167.6 13.97 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.018 -1.051 . . . . 0.0 109.69 -173.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . 0.3 9.8 t -131.68 -163.71 1.36 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.83 0.824 . . . . 0.0 109.557 -166.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 p -122.59 -1.63 9.0 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 120.874 -1.141 . . . . 0.0 111.209 152.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -153.48 145.44 23.62 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 124.606 1.163 . . . . 0.0 111.697 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.516 HH21 HG21 ' A' ' 72' ' ' VAL . 11.1 mmt180 -52.13 -33.75 41.35 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 167.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -79.71 -5.22 54.79 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 -173.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -133.11 163.93 28.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -168.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.496 ' HD2' ' H ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -69.45 164.02 24.0 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.553 1.168 . . . . 0.0 111.452 -164.866 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.496 ' H ' ' HD2' ' A' ' 102' ' ' LYS . 1.3 mm? -94.9 138.3 32.83 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.99 -1.005 . . . . 0.0 108.707 -174.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 7.8 mptt -60.38 169.18 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.627 1.171 . . . . 0.0 109.86 161.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -127.07 90.62 3.18 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.765 1.226 . . . . 0.0 109.849 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.71 83.66 1.88 Allowed 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 171.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.43 138.65 47.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 117.241 -1.361 . . . . 0.0 107.334 168.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.0 mt -133.79 -177.45 4.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 120.693 1.588 . . . . 0.0 106.795 171.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 62.1 p -101.13 155.73 17.83 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.666 0.746 . . . . 0.0 110.467 172.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 21.7 mt -59.83 -16.67 30.32 Favored 'General case' 0 C--O 1.237 0.435 0 O-C-N 121.641 -0.662 . . . . 0.0 112.238 166.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.16 -50.95 10.18 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 117.561 -1.209 . . . . 0.0 109.5 172.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -44.95 -61.27 1.68 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 124.403 1.081 . . . . 0.0 109.517 176.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.4 -36.93 74.31 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.214 0.916 . . . . 0.0 112.052 -168.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -65.2 -45.01 86.54 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.522 -0.736 . . . . 0.0 110.417 173.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.27 -2.01 26.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.868 2.067 . . . . 0.0 113.505 177.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -105.95 -46.57 4.07 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.067 1.747 . . . . 0.0 109.69 179.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -139.16 16.9 2.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.373 1.069 . . . . 0.0 113.248 -166.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -139.68 14.86 2.52 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 120.862 -1.149 . . . . 0.0 113.331 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.554 ' NE2' HE22 ' A' ' 123' ' ' GLN . 2.2 pm0 -58.2 -64.15 1.02 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 9.6 p -73.37 179.56 3.92 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.914 0.779 . . . . 0.0 111.286 -168.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 36.2 mtt85 -81.51 -55.85 4.41 Favored 'General case' 0 CA--C 1.507 -0.696 0 O-C-N 121.46 -0.775 . . . . 0.0 111.642 170.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 11.5 m -66.13 -26.99 67.7 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.191 -168.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.554 HE22 ' NE2' ' A' ' 119' ' ' GLN . 12.9 tt0 -55.64 -37.77 68.64 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.159 0.584 . . . . 0.0 111.015 173.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.4 mtpt -62.2 -28.43 69.67 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 118.157 -0.925 . . . . 0.0 110.71 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -63.86 -51.76 63.15 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.89 -57.31 9.15 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 123.6 0.76 . . . . 0.0 110.978 178.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 65.9 t -51.23 -51.14 24.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -73.78 -24.83 59.89 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.8 0.727 . . . . 0.0 112.555 -176.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -61.04 -48.02 83.67 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.926 0.89 . . . . 0.0 109.274 166.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 7.7 m-30 -61.28 -41.02 96.25 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.875 0.87 . . . . 0.0 109.719 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.0 t -64.17 -22.56 31.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 O-C-N 121.14 -0.975 . . . . 0.0 110.837 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -104.08 -13.94 16.09 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 119.842 1.201 . . . . 0.0 113.075 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.98 -27.17 58.85 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 124.459 1.028 . . . . 0.0 110.686 174.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.5 pp -73.42 147.29 44.37 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 118.3 1.05 . . . . 0.0 110.282 175.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -105.83 167.03 10.06 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.474 1.51 . . . . 0.0 107.785 -177.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.7 m -126.34 3.06 7.02 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.438 1.017 . . . . 0.0 111.431 175.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.149 0 C-N-CA 127.509 2.324 . . . . 0.0 107.181 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 . . . . . 0 CA--C 1.543 0.705 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.0 p -141.52 153.49 44.92 Favored 'General case' 0 N--CA 1.463 0.209 0 O-C-N 120.46 -1.4 . . . . 0.0 111.245 -177.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -61.21 -39.0 88.58 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.494 0.717 . . . . 0.0 110.846 -167.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -49.88 70.68 Favored 'General case' 0 C--N 1.341 0.196 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -177.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 60.9 mm-40 -60.81 -47.44 86.35 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.998 1.319 . . . . 0.0 109.29 -177.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 84.5 mt -61.34 -38.5 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 123.433 0.693 . . . . 0.0 110.242 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.64 -19.67 73.26 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 119.136 -0.813 . . . . 0.0 113.636 -178.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.9 t -70.53 -52.66 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 170.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.83 -36.29 83.44 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 122.297 -0.252 . . . . 0.0 110.755 -176.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.63 -49.67 69.98 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.424 0.69 . . . . 0.0 111.622 171.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.93 -34.3 88.14 Favored Glycine 0 CA--C 1.529 0.935 0 CA-C-O 119.56 -0.578 . . . . 0.0 111.726 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.19 -27.51 68.74 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.412 1.606 . . . . 0.0 112.041 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.36 -14.56 60.08 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.089 -1.007 . . . . 0.0 112.653 172.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.422 HD12 ' CE1' ' A' ' 95' ' ' TYR . 45.2 mm -136.43 89.65 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 124.947 1.299 . . . . 0.0 107.583 -167.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.65 60.49 1.42 Allowed Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.652 1.181 . . . . 0.0 110.376 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -58.28 -33.86 98.07 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.286 2.658 . . . . 0.0 112.511 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.61 -34.71 78.9 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.083 0.553 . . . . 0.0 111.762 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -64.94 -55.92 16.3 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 175.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.2 tt -49.15 -50.3 38.29 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.903 0.481 . . . . 0.0 110.055 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -55.56 -54.23 46.58 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.439 1.096 . . . . 0.0 112.041 177.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -56.82 -42.18 79.14 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.675 0.671 . . . . 0.0 111.689 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -65.02 -53.04 52.3 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.334 1.053 . . . . 0.0 109.992 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 mm -58.61 -40.88 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 C-N-CA 124.555 1.142 . . . . 0.0 109.78 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.17 -8.44 17.12 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.648 0.779 . . . . 0.0 112.802 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -121.36 5.86 10.18 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.013 1.725 . . . . 0.0 111.87 175.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 44.95 33.16 0.95 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.516 1.927 . . . . 0.0 111.825 -168.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -98.96 43.48 1.06 Allowed 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 176.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -134.52 142.46 47.02 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.572 1.078 . . . . 0.0 108.284 172.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.755 HG23 ' HB3' ' A' ' 135' ' ' ARG . 2.8 p -126.53 165.84 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 C-N-CA 126.651 1.98 . . . . 0.0 110.579 175.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -131.62 120.19 22.49 Favored 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 103.232 -2.877 . . . . 0.0 103.232 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -135.46 -178.98 16.11 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mm -122.39 144.54 31.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 C-N-CA 125.631 1.572 . . . . 0.0 107.545 172.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.7 t -45.85 -75.19 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 C-N-CA 128.481 2.713 . . . . 0.0 111.958 174.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.408 ' HB3' ' HD2' ' A' ' 57' ' ' PRO . 19.4 mmtp 57.3 166.61 0.07 OUTLIER Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 119.543 1.065 . . . . 0.0 111.326 -166.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 56' ' ' LYS . 96.1 Cg_endo -79.07 -4.06 13.61 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.29 1.993 . . . . 0.0 112.299 -178.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.7 p -58.31 -78.86 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 128.673 2.789 . . . . 0.0 111.808 -171.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.47 153.38 28.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.31 121.09 16.18 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.051 1.34 . . . . 0.0 109.048 -169.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.1 m -135.36 160.92 66.18 Favored Pre-proline 0 C--O 1.24 0.601 0 C-N-CA 123.962 0.905 . . . . 0.0 110.241 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.46 171.37 13.1 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.335 2.023 . . . . 0.0 110.603 170.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.37 151.4 34.88 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.425 171.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.9 47.82 11.02 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 124.653 1.121 . . . . 0.0 111.122 174.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.6 m -151.4 26.28 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 125.796 1.638 . . . . 0.0 110.15 170.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -61.75 -16.9 53.4 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.577 2.066 . . . . 0.0 116.577 -151.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -144.71 14.34 1.55 Allowed 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 128.082 2.553 . . . . 0.0 111.445 -172.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -70.69 149.47 46.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.186 1.395 . . . . 0.0 109.666 -179.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.2 m -73.25 164.28 26.9 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.892 163.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -142.19 158.36 43.83 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.218 1.007 . . . . 0.0 109.947 166.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.71 136.29 54.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.577 1.551 . . . . 0.0 107.96 170.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.1 p -152.4 155.48 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-N 119.454 1.024 . . . . 0.0 109.524 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.45 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -90.1 121.77 32.46 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 120.109 1.322 . . . . 0.0 109.186 176.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.43 -10.16 41.17 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -166.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -117.39 2.89 12.52 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.838 1.255 . . . . 0.0 110.903 -178.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.45 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 22.5 t0 -135.55 38.53 2.87 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 128.86 2.864 . . . . 0.0 106.902 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -64.74 -12.88 51.91 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 120.653 -1.279 . . . . 0.0 113.271 -163.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -107.83 3.81 24.79 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 127.94 2.496 . . . . 0.0 112.346 177.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.36 -78.37 0.98 Allowed Glycine 0 C--N 1.336 0.535 0 N-CA-C 110.239 -1.144 . . . . 0.0 110.239 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 20.7 m -121.64 156.81 32.21 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.463 1.105 . . . . 0.0 109.817 -174.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.4 tt -152.39 152.88 10.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.525 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 163.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 80.4 mt -133.59 117.79 28.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 172.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -84.17 153.87 23.42 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 170.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.7 p90 -155.34 162.85 40.73 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 120.924 -1.11 . . . . 0.0 110.265 165.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -145.12 129.11 17.48 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 117.971 0.35 . . . . 0.0 111.031 162.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HA ' HG22 ' A' ' 91' ' ' VAL . . . -71.32 118.65 14.38 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.707 0.803 . . . . 0.0 109.865 164.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -131.23 76.01 1.69 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.752 2.421 . . . . 0.0 106.138 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.16 -129.46 9.68 Favored Glycine 0 C--N 1.338 0.686 0 C-N-CA 124.684 1.135 . . . . 0.0 112.142 174.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -88.45 22.29 2.59 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.107 1.453 . . . . 0.0 112.129 170.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 93.9 m -137.16 148.37 46.55 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.945 1.698 . . . . 0.0 108.082 176.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.415 HG22 ' HA ' ' A' ' 86' ' ' ALA . 61.5 t -118.76 129.03 75.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 167.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 19.8 mm -91.39 108.32 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 105.009 -2.219 . . . . 0.0 105.009 169.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.402 HG21 HG13 ' A' ' 36' ' ' ILE . 8.8 mt -89.85 141.96 13.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 173.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.445 ' HB3' HD13 ' A' ' 103' ' ' LEU . 68.2 mttt -136.34 100.43 4.38 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 125.473 1.509 . . . . 0.0 108.17 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.422 ' CE1' HD12 ' A' ' 36' ' ' ILE . 34.9 p90 -115.6 165.89 12.52 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 122.75 0.42 . . . . 0.0 111.034 -174.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.505 HG23 ' O ' ' A' ' 98' ' ' GLN . 9.2 t -146.51 171.76 14.58 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 125.801 1.64 . . . . 0.0 107.573 172.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 53.0 p -106.45 19.7 20.11 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.399 1.479 . . . . 0.0 110.253 169.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . 0.505 ' O ' HG23 ' A' ' 96' ' ' THR . 8.0 mm-40 -127.91 -171.46 2.45 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.775 0.83 . . . . 0.0 109.217 167.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.71 -25.56 23.4 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 169.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -142.65 15.76 1.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -149.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.9 p -119.03 -179.92 3.97 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 119.754 1.161 . . . . 0.0 113.762 -170.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -53.22 125.4 17.43 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 123.666 0.786 . . . . 0.0 110.099 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 94' ' ' LYS . 58.6 mt -79.61 159.56 26.74 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 125.59 1.556 . . . . 0.0 109.043 -179.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -82.08 177.4 8.84 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 125.162 1.385 . . . . 0.0 110.162 171.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.37 119.76 35.57 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.256 1.422 . . . . 0.0 109.948 171.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.3 tptt -144.83 132.62 21.17 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 170.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -138.85 105.45 5.33 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 106.195 -1.779 . . . . 0.0 106.195 -171.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -118.22 145.44 44.99 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -174.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 37.4 p -75.02 153.05 38.66 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.332 0.515 . . . . 0.0 111.917 176.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.3 mt -60.5 -23.94 64.92 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 121.814 -0.554 . . . . 0.0 110.515 168.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.94 -46.41 71.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.321 172.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -51.41 -65.39 0.56 Allowed 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.462 1.105 . . . . 0.0 110.304 176.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.74 -34.87 73.51 Favored 'General case' 0 CA--C 1.521 -0.137 0 C-N-CA 122.781 0.432 . . . . 0.0 111.878 -170.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -69.74 -34.03 73.27 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.906 -0.496 . . . . 0.0 109.834 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -53.92 12.29 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.982 174.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -53.43 -56.74 14.37 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.14 0.976 . . . . 0.0 110.706 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -124.09 11.62 8.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.167 0.987 . . . . 0.0 113.171 -160.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -143.99 23.46 1.7 Allowed 'General case' 0 CA--C 1.537 0.454 0 O-C-N 120.525 -1.359 . . . . 0.0 114.475 175.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.651 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -69.53 -40.29 76.99 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 120.27 -1.519 . . . . 0.0 114.418 -171.445 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.8 t -107.05 173.57 6.27 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 126.369 1.868 . . . . 0.0 109.048 -163.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 2.2 mtm-85 -79.65 -47.85 14.71 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 124.104 0.961 . . . . 0.0 112.593 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.0 m -57.42 -37.61 73.03 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.731 0.645 . . . . 0.0 110.519 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.651 HE22 ' NE2' ' A' ' 119' ' ' GLN . 15.1 tt0 -62.33 -29.79 70.7 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.454 -0.779 . . . . 0.0 111.796 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 29.4 mtpt -65.68 -33.49 76.01 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 118.047 -0.977 . . . . 0.0 109.801 -178.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -49.38 78.04 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 176.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -69.63 -56.84 6.14 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 118.633 -0.698 . . . . 0.0 110.202 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 53.5 t -49.32 -53.31 9.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 123.882 0.873 . . . . 0.0 110.826 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -71.59 -17.56 62.28 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.731 0.696 . . . . 0.0 112.043 -177.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -80.7 -29.94 36.44 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.24 -0.912 . . . . 0.0 111.126 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -64.37 -36.64 84.79 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 167.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 26.1 t -64.68 -23.47 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 121.04 -1.038 . . . . 0.0 110.653 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -89.73 15.32 9.87 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.782 -1.199 . . . . 0.0 112.25 174.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -136.23 9.31 4.12 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 124.693 1.139 . . . . 0.0 114.258 -174.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.2 22.88 11.93 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -161.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.755 ' HB3' HG23 ' A' ' 51' ' ' VAL . 19.2 mtt180 44.26 -164.04 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 130.675 3.59 . . . . 0.0 110.773 179.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.36 -5.12 0.39 Allowed 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 118.892 -1.123 . . . . 0.0 112.685 159.115 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 . . . . . 0 C--O 1.254 1.322 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 -173.016 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 . . . . . 0 CA--C 1.534 0.328 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.0 p -120.26 170.68 9.11 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 165.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -62.65 -43.53 98.58 Favored 'General case' 0 C--O 1.233 0.22 0 O-C-N 121.743 -0.598 . . . . 0.0 110.078 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -48.83 80.06 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 123.987 0.915 . . . . 0.0 109.977 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.8 mm-40 -55.55 -47.36 76.46 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 125.49 1.516 . . . . 0.0 110.391 -175.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.4 mt -64.15 -33.41 62.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -178.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -65.88 -30.84 77.95 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-O 118.957 -0.913 . . . . 0.0 113.871 178.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.446 HG21 HG22 ' A' ' 131' ' ' VAL . 61.6 t -75.89 -44.75 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mp -55.42 -45.46 76.75 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.008 0.523 . . . . 0.0 110.449 173.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.46 -42.46 96.21 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.942 0.497 . . . . 0.0 111.672 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.33 -20.75 79.55 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 112.115 -0.394 . . . . 0.0 112.115 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.6 mp -69.77 -26.87 64.5 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.985 -1.303 . . . . 0.0 111.803 173.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.428 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -80.88 -27.56 36.26 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 171.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.428 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.3 mp -127.08 95.18 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -174.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m 67.51 63.5 0.73 Allowed Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.398 1.479 . . . . 0.0 113.009 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.94 -42.4 37.56 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.243 2.628 . . . . 0.0 111.721 176.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.12 -42.71 75.7 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.408 -0.807 . . . . 0.0 110.563 -173.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . 0.463 ' HA ' ' HG2' ' A' ' 43' ' ' GLN . 37.6 t90 -60.04 -37.58 80.21 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.087 0.555 . . . . 0.0 111.604 175.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.31 -63.32 1.34 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 172.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -55.13 -36.83 66.17 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 123.585 0.754 . . . . 0.0 112.286 -173.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.463 ' HG2' ' HA ' ' A' ' 40' ' ' TRP 0.252 1.5 pt20 -64.59 -45.15 88.2 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 118.193 0.452 . . . . 0.0 111.166 -176.32 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -69.06 -34.16 74.73 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 124.157 0.983 . . . . 0.0 110.616 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.7 mm -58.87 -45.18 91.82 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.494 166.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.03 -4.3 4.54 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -177.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.57 10.08 7.19 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.276 1.03 . . . . 0.0 111.658 170.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 49.14 31.29 3.42 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.439 2.295 . . . . 0.0 113.111 -173.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -91.13 3.37 54.95 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.196 1.799 . . . . 0.0 115.657 -174.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.457 HD21 HD22 ' A' ' 71' ' ' LEU . 55.5 tp -87.47 139.53 30.45 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.099 1.318 . . . . 0.0 110.758 -177.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 71.8 t -114.33 123.62 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 C-N-CA 124.856 1.263 . . . . 0.0 107.69 165.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -71.93 135.16 46.4 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.269 1.428 . . . . 0.0 107.791 156.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -147.24 167.59 28.44 Favored Glycine 0 C--N 1.333 0.406 0 CA-C-N 118.633 0.652 . . . . 0.0 112.281 175.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 20.0 mm -117.49 134.38 61.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 106.153 -1.795 . . . . 0.0 106.153 173.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.668 HG13 HG11 ' A' ' 61' ' ' VAL . 28.8 t -47.91 -71.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 C-N-CA 128.194 2.597 . . . . 0.0 110.089 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 21.2 mttt 58.65 159.03 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.517 0 C-N-CA 127.115 2.166 . . . . 0.0 113.276 -166.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.69 -12.32 30.95 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 121.872 1.715 . . . . 0.0 111.732 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -60.87 -14.18 20.43 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.214 1.405 . . . . 0.0 112.509 175.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -131.38 -173.53 3.14 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 120.237 1.381 . . . . 0.0 112.264 -173.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 24.6 m -129.2 101.69 6.13 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.744 1.218 . . . . 0.0 107.803 -149.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.668 HG11 HG13 ' A' ' 55' ' ' VAL . 4.9 m -142.96 157.19 61.49 Favored Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 124.977 1.311 . . . . 0.0 110.859 -154.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -67.24 172.04 10.63 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 122.279 1.986 . . . . 0.0 111.573 175.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.52 141.33 57.91 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.775 0.83 . . . . 0.0 111.366 176.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.61 43.16 45.0 Favored Glycine 0 CA--C 1.485 -1.791 0 C-N-CA 124.299 0.952 . . . . 0.0 113.234 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.683 HG23 ' HB2' ' A' ' 68' ' ' TYR 0.252 1.6 p -170.37 80.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.416 -2.135 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 177.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -98.82 -6.64 28.82 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.015 -1.448 . . . . 0.0 112.235 162.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -152.4 -1.64 0.27 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -168.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.683 ' HB2' HG23 ' A' ' 65' ' ' VAL . 3.3 m-85 -67.92 115.66 7.69 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 119.657 1.117 . . . . 0.0 108.343 178.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -53.8 139.16 33.98 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.777 1.231 . . . . 0.0 109.948 -177.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 22.3 p90 -122.38 167.15 13.64 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.353 0.661 . . . . 0.0 112.665 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.457 HD22 HD21 ' A' ' 50' ' ' LEU . 54.0 mt -143.22 125.71 15.77 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 127.336 2.254 . . . . 0.0 106.47 -174.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.6 p -157.39 155.52 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 125.144 1.378 . . . . 0.0 108.397 -178.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.87 157.17 16.92 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.416 1.007 . . . . 0.0 110.422 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.01 -25.62 63.82 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 -166.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -106.71 -8.65 16.77 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 124.549 1.14 . . . . 0.0 112.339 -174.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.6 p30 -123.48 32.55 5.6 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.905 0.882 . . . . 0.0 109.233 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -51.72 -22.42 3.5 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.197 0.999 . . . . 0.0 113.556 173.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -116.47 6.43 13.57 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.77 1.628 . . . . 0.0 112.877 175.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.82 -126.13 1.75 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 126.39 1.948 . . . . 0.0 110.553 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.0 m -64.2 160.1 19.24 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 170.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.2 tt -157.46 147.8 10.24 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 160.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 88.9 mt -126.99 135.46 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -119.61 157.14 29.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 126.012 1.725 . . . . 0.0 106.983 176.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -159.72 153.81 23.4 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 120.425 -1.422 . . . . 0.0 108.906 172.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.79 110.68 13.36 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 166.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.74 84.32 0.9 Allowed 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 161.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -75.96 -169.53 1.14 Allowed 'General case' 0 C--O 1.24 0.555 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.62 104.56 0.39 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 124.19 0.9 . . . . 0.0 111.007 178.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 62.55 14.72 7.3 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.323 1.449 . . . . 0.0 111.614 168.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.0 m -144.44 138.96 28.06 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.571 1.948 . . . . 0.0 107.985 -172.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 18.5 t -115.38 112.03 38.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 169.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.429 HD12 ' H ' ' A' ' 92' ' ' ILE . 4.2 mp -86.64 104.12 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 N-CA-C 105.726 -1.953 . . . . 0.0 105.726 166.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 mt -86.54 113.78 24.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -108.4 98.7 8.19 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 126.32 1.848 . . . . 0.0 108.63 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -124.25 165.89 16.85 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 119.925 -1.735 . . . . 0.0 110.533 -175.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.5 t -154.22 171.27 19.47 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.635 1.574 . . . . 0.0 108.774 -177.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.5 -11.74 19.07 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.651 1.58 . . . . 0.0 111.288 174.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -147.6 145.51 29.03 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.15 176.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.0 tpt85 -53.8 -41.35 67.2 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.139 0.976 . . . . 0.0 109.796 173.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . 0.407 HD22 ' C ' ' A' ' 100' ' ' ASN . 0.1 OUTLIER -78.56 26.68 0.22 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.489 1.515 . . . . 0.0 114.94 176.382 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.95 158.6 43.9 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 119.753 -1.842 . . . . 0.0 112.131 172.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 103' ' ' LEU . 3.4 tptm -63.29 166.68 6.02 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 124.397 1.079 . . . . 0.0 109.616 169.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.416 ' H ' ' HG3' ' A' ' 102' ' ' LYS . 26.5 mt -105.88 156.52 18.27 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 125.822 1.649 . . . . 0.0 108.613 -172.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -71.79 -179.28 2.59 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.652 1.181 . . . . 0.0 109.563 165.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -142.99 70.84 1.33 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.18 0.992 . . . . 0.0 108.647 167.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -70.64 101.14 1.98 Allowed 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 170.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -95.3 136.29 35.84 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 175.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 29.1 mt -146.89 153.95 40.73 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.391 1.876 . . . . 0.0 106.334 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 11.9 p -76.53 154.8 34.25 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.501 -0.749 . . . . 0.0 111.2 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 11.8 mt -59.96 -25.52 65.26 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.188 -0.945 . . . . 0.0 110.531 169.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.23 -46.29 70.91 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 117.264 -1.35 . . . . 0.0 112.607 170.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.95 -60.19 2.4 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.067 1.347 . . . . 0.0 110.079 177.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.17 -42.22 85.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.345 1.458 . . . . 0.0 110.54 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -66.44 -34.07 77.12 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.471 -0.768 . . . . 0.0 110.257 -178.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.15 -66.58 0.54 Allowed 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 175.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -49.74 -42.15 45.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 126.584 1.954 . . . . 0.0 114.333 -166.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -128.1 18.51 6.56 Favored 'General case' 0 C--O 1.226 -0.146 0 CA-C-N 118.181 0.446 . . . . 0.0 111.636 -173.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -142.71 17.17 1.99 Allowed 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.631 -0.668 . . . . 0.0 111.359 177.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.579 ' NE2' HE22 ' A' ' 123' ' ' GLN . 2.6 pm0 -51.05 -74.13 0.03 OUTLIER 'General case' 0 C--N 1.351 0.663 0 CA-C-N 119.313 0.961 . . . . 0.0 111.801 165.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.64 151.04 27.8 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 -169.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 62.5 ttt-85 -75.86 -21.43 57.22 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-O 117.702 -1.142 . . . . 0.0 112.382 173.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 1.4 t -59.66 -50.25 74.6 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 119.933 1.242 . . . . 0.0 108.179 175.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.579 HE22 ' NE2' ' A' ' 119' ' ' GLN . 2.9 pt20 -61.65 -24.89 67.02 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.229 0.468 . . . . 0.0 111.917 -177.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -69.93 -5.19 24.36 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 118.031 -0.985 . . . . 0.0 112.677 176.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? -70.97 -75.54 0.12 Allowed 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 155.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -55.57 -47.3 76.64 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -162.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 71.2 t -55.1 -51.36 55.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 125.091 1.356 . . . . 0.0 110.194 177.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.17 -27.42 60.81 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.93 0.892 . . . . 0.0 110.926 -177.155 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.61 -51.26 70.56 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.543 2.337 . . . . 0.0 108.542 169.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -57.31 -27.96 62.64 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.577 0.751 . . . . 0.0 111.394 -178.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.446 HG22 HG21 ' A' ' 30' ' ' VAL . 60.2 t -75.36 -25.62 18.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 O-C-N 121.205 -0.935 . . . . 0.0 112.171 177.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -90.8 -18.11 25.46 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.457 -0.777 . . . . 0.0 111.159 173.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.31 9.91 73.4 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.063 1.316 . . . . 0.0 114.658 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.424 ' HB3' HD23 ' A' ' 50' ' ' LEU . 3.8 pp -104.65 167.64 9.6 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.968 1.307 . . . . 0.0 111.667 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 49.8 mtp85 -109.53 176.71 4.98 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 125.47 1.508 . . . . 0.0 108.671 172.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.82 3.94 1.87 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.752 0.421 . . . . 0.0 111.216 -169.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 . . . . . 0 C--O 1.246 0.915 0 C-N-CA 129.113 2.965 . . . . 0.0 109.839 -158.987 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.24 0.583 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.15 137.71 54.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.508 1.523 . . . . 0.0 107.956 175.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -69.58 -40.09 76.94 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.757 -0.59 . . . . 0.0 110.282 -166.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.4 HE22 HD11 ' A' ' 134' ' ' LEU . 1.1 mm100 -45.6 -51.05 12.62 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.37 1.468 . . . . 0.0 110.231 165.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -69.59 -37.39 76.9 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.561 1.144 . . . . 0.0 112.053 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.7 mt -62.52 -36.49 75.21 Favored 'Isoleucine or valine' 0 C--N 1.342 0.278 0 CA-C-N 120.499 1.5 . . . . 0.0 110.909 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -51.85 -48.13 51.83 Favored Glycine 0 C--N 1.336 0.571 0 CA-C-N 119.65 1.113 . . . . 0.0 112.827 -174.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.4 t -62.26 -46.23 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-N 117.226 0.513 . . . . 0.0 110.084 -178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.491 HD21 HG11 ' A' ' 127' ' ' VAL . 80.6 mt -70.68 -34.09 71.61 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.327 0.651 . . . . 0.0 111.436 -176.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.26 -48.46 78.08 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.04 0.936 . . . . 0.0 109.631 171.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.75 -34.62 78.15 Favored Glycine 0 C--N 1.336 0.578 0 N-CA-C 111.644 -0.582 . . . . 0.0 111.644 175.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.1 mt -63.78 -31.06 72.11 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 120.607 -1.525 . . . . 0.0 110.794 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.14 -19.14 57.27 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 117.592 -1.194 . . . . 0.0 113.252 172.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.0 mm -144.4 93.0 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 125.905 1.682 . . . . 0.0 108.085 -163.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t 56.27 71.66 1.15 Allowed Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 126.5 1.92 . . . . 0.0 111.629 -171.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -60.58 -42.88 36.42 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.447 2.098 . . . . 0.0 109.208 171.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.86 -56.23 13.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.195 1.398 . . . . 0.0 110.99 177.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 69.3 t90 -53.07 -53.21 53.66 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.543 0.61 . . . . 0.0 110.214 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.7 tt -59.1 -48.26 82.26 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 118.438 0.563 . . . . 0.0 110.678 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.0 mttm -56.0 -45.55 79.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 118.679 0.672 . . . . 0.0 110.589 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -69.3 -39.57 78.22 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -65.27 -46.84 78.85 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.391 -0.818 . . . . 0.0 111.257 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.6 mm -60.87 -35.29 63.71 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.114 0 C-N-CA 123.9 0.88 . . . . 0.0 110.416 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.48 -39.76 58.16 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.03 0.832 . . . . 0.0 111.319 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -100.98 6.23 43.45 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.013 1.725 . . . . 0.0 113.302 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 54.27 19.39 2.19 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.199 1.799 . . . . 0.0 112.147 -171.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -83.25 10.01 9.41 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 119.984 -1.698 . . . . 0.0 112.128 -178.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.4 tp -84.85 145.92 27.58 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 171.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . 0.579 HG23 ' CB ' ' A' ' 135' ' ' ARG . 3.5 p -128.45 165.52 27.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 125.119 1.368 . . . . 0.0 108.876 167.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -134.11 159.31 41.23 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 128.874 2.87 . . . . 0.0 105.801 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.59 175.51 43.98 Favored Glycine 0 CA--C 1.517 0.184 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 177.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 42.2 mm -113.8 134.68 55.84 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.715 0 C-N-CA 126.463 1.905 . . . . 0.0 106.589 178.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.525 HG12 HG11 ' A' ' 61' ' ' VAL . 0.4 OUTLIER -44.51 -82.96 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.421 -1.919 1 C-N-CA 132.063 4.145 . . . . 0.0 111.718 169.067 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.515 ' H ' HG23 ' A' ' 55' ' ' VAL . 15.1 mmtt 60.33 166.24 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 124.838 1.255 . . . . 0.0 112.551 -173.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -65.08 -6.91 13.94 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.341 2.027 . . . . 0.0 115.256 167.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.2 m -91.92 -48.52 6.72 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 120.086 1.312 . . . . 0.0 113.872 -166.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.73 169.89 16.41 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.385 0.993 . . . . 0.0 108.972 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.8 m -80.13 108.52 13.79 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 174.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.525 HG11 HG12 ' A' ' 55' ' ' VAL . 2.6 m -131.89 163.19 51.7 Favored Pre-proline 0 C--O 1.238 0.472 0 C-N-CA 125.292 1.437 . . . . 0.0 108.972 167.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -75.6 164.06 32.91 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 121.572 1.515 . . . . 0.0 111.695 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.13 123.43 15.24 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.332 169.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 105.35 26.92 6.03 Favored Glycine 0 CA--C 1.529 0.911 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.026 172.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.1 m -144.21 81.77 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.51 1.524 . . . . 0.0 108.478 172.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -89.85 -14.42 34.39 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.15 1.908 . . . . 0.0 116.15 -172.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -165.32 14.9 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 126.863 2.065 . . . . 0.0 110.599 -176.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.426 ' CG ' ' HB2' ' A' ' 85' ' ' LYS . 10.3 m-85 -77.13 110.12 11.55 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 175.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.3 m -49.99 139.05 14.5 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.36 0.664 . . . . 0.0 109.483 168.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 83' ' ' PHE . 36.8 p90 -112.29 170.38 8.21 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.099 0.863 . . . . 0.0 110.703 174.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.9 mt -135.3 135.9 41.18 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.0 2.12 . . . . 0.0 106.241 169.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.547 ' HB ' HG13 ' A' ' 81' ' ' ILE . 4.1 p -144.41 162.24 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 CA-C-N 119.398 0.999 . . . . 0.0 108.727 175.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.67 122.82 28.64 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 172.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.06 -30.76 71.34 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 119.085 0.857 . . . . 0.0 110.906 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.85 -10.13 29.7 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 124.359 1.064 . . . . 0.0 112.236 -176.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.16 53.73 1.96 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 176.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -47.72 -46.4 29.63 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.918 -0.489 . . . . 0.0 112.271 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -85.75 2.63 44.74 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.937 1.295 . . . . 0.0 111.969 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.5 -69.13 1.36 Allowed Glycine 0 CA--C 1.532 1.097 0 C-N-CA 126.261 1.886 . . . . 0.0 113.893 -165.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.7 m -143.47 158.72 43.42 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.451 1.5 . . . . 0.0 109.206 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.547 HG13 ' HB ' ' A' ' 72' ' ' VAL . 7.3 tt -155.51 155.11 5.97 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-N 119.315 0.961 . . . . 0.0 109.118 177.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.4 mt -139.02 150.59 23.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 175.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 70' ' ' TYR . 50.3 m-85 -128.86 153.77 47.14 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 126.202 1.801 . . . . 0.0 107.592 171.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -152.03 158.5 43.15 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.819 1.248 . . . . 0.0 109.793 175.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.426 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 10.3 tttt -155.62 125.53 6.53 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 123.996 0.919 . . . . 0.0 108.898 176.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.2 158.15 32.03 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.141 0.428 . . . . 0.0 110.646 167.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -137.87 -3.65 1.81 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 177.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 113.17 81.46 1.07 Allowed Glycine 0 C--N 1.338 0.643 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 75.44 7.55 3.96 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.189 2.596 . . . . 0.0 114.527 -173.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.1 m -141.0 160.49 39.96 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.714 1.605 . . . . 0.0 108.064 174.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 87.9 t -134.23 139.77 47.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 C-N-CA 126.324 1.85 . . . . 0.0 106.371 174.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 23.8 mm -103.15 114.82 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 173.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.8 mt -94.12 130.91 42.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 173.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -125.02 97.71 5.37 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 126.994 2.118 . . . . 0.0 107.192 -176.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 25.0 p90 -124.76 169.79 11.66 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.508 -1.37 . . . . 0.0 110.094 -171.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.4 t -154.31 168.36 26.85 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.301 0.64 . . . . 0.0 109.498 176.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.0 p -91.1 -10.59 41.44 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.779 1.632 . . . . 0.0 112.244 170.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -147.17 123.25 10.78 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.385 1.074 . . . . 0.0 110.236 -170.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 -51.99 -36.03 48.46 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 125.113 1.365 . . . . 0.0 111.695 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.03 -3.48 32.75 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.947 1.699 . . . . 0.0 114.925 -173.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.4 p -119.95 171.92 8.1 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -162.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.05 152.03 41.4 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 121.287 -0.883 . . . . 0.0 109.264 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -85.53 135.37 33.85 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 172.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.72 176.12 0.41 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.266 1.427 . . . . 0.0 109.391 162.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.28 106.0 4.48 Favored 'General case' 0 C--O 1.232 0.181 0 O-C-N 121.355 -0.84 . . . . 0.0 109.561 -175.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.451 ' HG2' HD21 ' A' ' 108' ' ' LEU . 2.5 tppt? -121.66 108.08 13.13 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 106.363 -1.718 . . . . 0.0 106.363 171.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -81.27 140.74 34.67 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 169.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.451 HD21 ' HG2' ' A' ' 106' ' ' LYS . 3.0 mm? -135.3 135.96 41.23 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 106.819 -1.548 . . . . 0.0 106.819 171.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.37 153.81 33.94 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.718 0.807 . . . . 0.0 109.648 172.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.0 mt -55.68 -43.12 76.06 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.268 -1.52 . . . . 0.0 108.46 166.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.9 t -51.67 -55.09 21.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.902 -0.57 . . . . 0.0 109.959 177.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -44.53 -66.34 0.4 Allowed 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 127.568 2.347 . . . . 0.0 110.48 175.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 83.4 mt -64.14 -31.65 72.93 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.665 -175.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -70.29 -39.71 74.71 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.959 -1.088 . . . . 0.0 108.225 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -51.02 61.16 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 117.885 -1.055 . . . . 0.0 108.623 174.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -55.68 -44.81 77.65 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 118.774 0.715 . . . . 0.0 111.705 -174.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -141.85 16.36 2.13 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -157.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -148.49 42.01 0.98 Allowed 'General case' 0 C--O 1.238 0.453 0 O-C-N 120.049 -1.657 . . . . 0.0 111.496 175.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.5 -26.47 13.23 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -170.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 41.5 p -92.49 -174.97 3.85 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.167 1.387 . . . . 0.0 109.765 -178.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.29 -46.64 4.96 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 120.545 -1.347 . . . . 0.0 110.768 -176.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 70.4 m -63.0 -31.01 72.05 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 119.133 0.879 . . . . 0.0 111.297 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -62.12 -16.83 55.23 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.75 -1.219 . . . . 0.0 112.9 177.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -65.35 -25.07 67.43 Favored 'General case' 0 N--CA 1.462 0.166 0 O-C-N 121.368 -0.832 . . . . 0.0 111.014 172.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -77.33 -67.67 0.69 Allowed 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 168.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -53.65 -51.76 62.12 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 124.458 1.098 . . . . 0.0 112.57 -157.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . 0.491 HG11 HD21 ' A' ' 31' ' ' LEU . 36.4 t -53.2 -55.48 12.38 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 C-N-CA 123.997 0.919 . . . . 0.0 109.216 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -67.59 -28.23 67.58 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -176.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -65.35 -38.32 89.75 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 124.553 1.141 . . . . 0.0 109.757 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 9.2 m-30 -62.47 -33.47 74.92 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.695 0.798 . . . . 0.0 111.146 169.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 11.2 t -70.24 -16.08 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 120.569 -1.332 . . . . 0.0 111.242 173.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -107.83 18.01 21.82 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.086 1.355 . . . . 0.0 110.757 173.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -122.39 18.98 8.18 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 125.658 1.599 . . . . 0.0 111.252 175.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.4 HD11 HE22 ' A' ' 26' ' ' GLN . 3.8 pp -125.48 151.23 46.56 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.279 1.032 . . . . 0.0 111.35 -178.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.579 ' CB ' HG23 ' A' ' 51' ' ' VAL . 19.1 mtt85 -72.32 178.5 3.9 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 126.98 2.112 . . . . 0.0 108.951 170.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.88 -0.89 2.05 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -175.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.256 1.417 0 C-N-CA 126.485 1.914 . . . . 0.0 108.138 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 . . . . . 0 N--CA 1.455 -0.218 0 CA-C-O 121.899 0.857 . . . . 0.0 112.732 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.6 p -129.69 154.59 47.0 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 104.711 -2.329 . . . . 0.0 104.711 162.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.611 ' HA ' HD12 ' A' ' 28' ' ' ILE . 2.9 m-20 -63.75 -32.64 74.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.768 0.258 . . . . 0.0 110.406 -170.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -47.71 83.47 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.056 0.943 . . . . 0.0 111.252 175.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -62.76 -45.8 91.02 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.366 1.066 . . . . 0.0 109.289 -175.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.611 HD12 ' HA ' ' A' ' 25' ' ' ASP . 28.5 mt -61.52 -44.7 99.04 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 C-N-CA 124.817 1.247 . . . . 0.0 108.342 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.57 -37.57 56.64 Favored Glycine 0 CA--C 1.523 0.562 0 C-N-CA 124.168 0.89 . . . . 0.0 111.881 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 75.5 t -64.73 -59.77 3.71 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.137 0 CA-C-N 118.47 1.135 . . . . 0.0 109.042 173.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.43 ' CB ' HD22 ' A' ' 113' ' ' LEU . 33.9 mt -58.36 -42.48 87.03 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.432 1.014 . . . . 0.0 110.787 -172.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.26 93.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.64 1.176 . . . . 0.0 111.45 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.82 -25.19 75.85 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 118.164 0.438 . . . . 0.0 112.342 175.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.1 mt -69.99 -41.09 74.84 Favored 'General case' 0 C--O 1.231 0.125 0 O-C-N 120.449 -1.618 . . . . 0.0 110.008 173.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.33 -32.13 73.47 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 119.212 -0.423 . . . . 0.0 111.312 173.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.438 HG21 ' CG ' ' A' ' 95' ' ' TYR . 32.1 mm -126.75 97.74 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 125.908 1.683 . . . . 0.0 107.889 -170.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.276 1.0 OUTLIER 65.83 67.67 0.72 Allowed Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.066 1.746 . . . . 0.0 112.559 173.129 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.79 -35.73 9.16 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.261 2.641 . . . . 0.0 113.285 -176.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -58.97 -58.93 6.47 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.275 1.03 . . . . 0.0 110.104 -177.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 48.8 t90 -47.7 -49.7 27.17 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.481 1.512 . . . . 0.0 111.203 175.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.7 tt -58.86 -47.56 84.48 Favored 'General case' 0 C--N 1.34 0.155 0 O-C-N 121.624 -0.672 . . . . 0.0 110.343 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -63.24 -38.5 91.4 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 117.841 -1.076 . . . . 0.0 111.606 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -61.44 -40.1 93.23 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 119.625 1.102 . . . . 0.0 109.775 176.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -75.24 -45.51 39.73 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.16 -175.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.91 -45.3 98.52 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-N 119.487 1.039 . . . . 0.0 109.627 176.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.29 -39.26 72.41 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.807 0.73 . . . . 0.0 110.306 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.93 0.79 46.43 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 44.41 45.54 7.53 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 126.463 1.905 . . . . 0.0 111.003 -168.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.55 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -104.82 -2.31 24.93 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 177.445 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.0 tp -85.5 119.17 25.56 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 120.175 1.352 . . . . 0.0 110.638 -171.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 42.9 t -107.4 120.51 58.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 C-N-CA 125.544 1.538 . . . . 0.0 109.034 -178.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -89.94 153.3 20.72 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 128.124 2.57 . . . . 0.0 108.66 165.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -178.94 175.2 47.17 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 27.7 mm -115.12 136.3 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 124.599 1.159 . . . . 0.0 108.283 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.533 HG13 HG11 ' A' ' 61' ' ' VAL . 27.5 t -53.4 -75.82 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 129.925 3.29 . . . . 0.0 111.349 -175.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.0 mttt 59.27 167.37 0.08 OUTLIER Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 123.984 0.914 . . . . 0.0 112.191 -172.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.98 -4.47 8.93 Favored 'Trans proline' 0 CA--C 1.549 1.253 0 CA-C-N 121.104 1.43 . . . . 0.0 112.747 169.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.1 m -81.04 3.94 21.45 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 126.44 1.896 . . . . 0.0 114.989 -168.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.19 -175.42 4.1 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 120.002 1.273 . . . . 0.0 111.335 171.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.458 ' O ' HG13 ' A' ' 61' ' ' VAL . 8.9 t -75.51 143.8 42.32 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 162.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.533 HG11 HG13 ' A' ' 55' ' ' VAL . 0.4 OUTLIER -160.64 157.62 23.87 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 124.316 1.046 . . . . 0.0 110.296 165.583 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.36 -177.99 3.67 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 123.891 3.061 . . . . 0.0 111.379 174.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.71 137.2 40.47 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 123.639 0.776 . . . . 0.0 112.567 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.15 60.75 6.78 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 125.131 1.348 . . . . 0.0 109.874 173.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -144.16 30.59 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 125.536 1.535 . . . . 0.0 109.785 165.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -55.19 -15.76 2.6 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 117.7 2.481 . . . . 0.0 117.7 -160.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -154.6 26.74 0.45 Allowed 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.362 1.465 . . . . 0.0 110.488 171.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -71.96 108.85 5.42 Favored 'General case' 0 CA--C 1.519 -0.234 0 O-C-N 121.321 -0.862 . . . . 0.0 108.742 174.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.4 m -50.24 137.69 17.7 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.235 1.414 . . . . 0.0 109.846 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 23.8 p90 -118.97 160.8 21.32 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 118.71 0.686 . . . . 0.0 111.33 -177.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.0 mt -135.82 133.78 38.2 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 127.566 2.346 . . . . 0.0 106.43 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.9 p -161.72 167.87 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 105.161 -2.163 . . . . 0.0 105.161 -169.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.06 -175.93 4.83 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.999 -1.063 . . . . 0.0 108.67 169.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -93.18 -14.46 27.12 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.6 -0.688 . . . . 0.0 112.759 161.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -139.28 22.21 2.57 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.932 0.893 . . . . 0.0 112.166 -161.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -138.17 34.45 2.33 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.8 1.64 . . . . 0.0 107.926 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -60.99 -18.79 59.52 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 119.651 -1.905 . . . . 0.0 113.473 -160.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -98.73 3.47 47.63 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.786 1.634 . . . . 0.0 113.779 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -94.96 -128.84 5.53 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 125.931 1.729 . . . . 0.0 111.679 -171.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 25.4 m -70.75 156.28 39.71 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.595 -0.944 . . . . 0.0 109.069 173.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.3 tt -151.03 158.92 4.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 164.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 57.9 mt -136.07 143.12 36.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 106.055 -1.831 . . . . 0.0 106.055 174.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -122.21 154.98 36.78 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 172.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -156.69 158.82 37.65 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.24 -0.912 . . . . 0.0 108.918 169.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.4 tttt -142.19 109.35 5.54 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 160.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.589 ' HB3' HD13 ' A' ' 28' ' ' ILE . . . -82.69 149.93 27.05 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 165.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -141.64 -154.12 0.5 Allowed 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 128.352 2.661 . . . . 0.0 107.144 -171.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -68.97 89.29 0.24 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 125.073 1.32 . . . . 0.0 110.026 -176.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 62.22 11.0 4.13 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.989 2.116 . . . . 0.0 114.149 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.89 162.9 24.83 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.515 1.507 . . . . 0.0 108.934 174.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 107' ' ' ALA . 8.4 p -146.82 151.86 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.145 0 C-N-CA 124.811 1.245 . . . . 0.0 108.06 168.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.422 HG22 ' HG3' ' A' ' 94' ' ' LYS . 3.4 mp -116.53 109.45 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 166.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.2 mt -83.04 127.54 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 165.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.422 ' HG3' HG22 ' A' ' 92' ' ' ILE . 75.7 mttt -120.15 105.29 10.84 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.417 1.887 . . . . 0.0 109.017 178.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.438 ' CG ' HG21 ' A' ' 36' ' ' ILE . 26.7 p90 -126.02 167.68 14.99 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.858 -1.151 . . . . 0.0 110.461 -176.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -156.79 163.59 39.06 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.574 1.55 . . . . 0.0 107.303 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 45.5 p -82.21 -17.32 46.54 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 169.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -145.43 133.17 21.08 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.94 -41.58 11.76 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 129.38 3.072 . . . . 0.0 111.312 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -81.66 7.16 13.07 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -175.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.8 p -136.71 132.61 35.11 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.018 -1.677 . . . . 0.0 111.914 -169.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.414 ' HD2' ' H ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -53.65 147.27 11.67 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.432 1.093 . . . . 0.0 112.712 -166.034 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.444 ' H ' HD22 ' A' ' 103' ' ' LEU . 1.8 mm? -71.1 163.61 27.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.568 1.547 . . . . 0.0 111.79 -172.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.3 mptp? -84.17 177.39 8.24 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 127.454 2.302 . . . . 0.0 109.332 167.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -123.95 118.81 27.88 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.221 1.808 . . . . 0.0 107.955 171.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -127.62 126.47 42.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 103.967 -2.605 . . . . 0.0 103.967 164.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.41 ' HA ' ' O ' ' A' ' 91' ' ' VAL . . . -123.86 130.29 52.36 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 120.924 1.693 . . . . 0.0 108.914 179.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 29.2 mt -134.48 155.88 49.59 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 -173.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.5 p -87.18 151.0 23.56 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 121.282 1.856 . . . . 0.0 109.107 170.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 16.6 mt -58.66 -40.4 83.38 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-O 121.762 0.791 . . . . 0.0 109.755 -176.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.3 -37.33 82.82 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 124.407 1.083 . . . . 0.0 110.914 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -57.77 11.09 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 125.931 1.692 . . . . 0.0 112.255 173.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . 0.575 HD23 ' OE2' ' A' ' 116' ' ' GLU . 14.7 mt -56.35 -33.01 65.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.702 1.137 . . . . 0.0 110.136 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -72.59 12.1 0.53 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.127 1.371 . . . . 0.0 113.713 175.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.26 -35.02 1.04 Allowed 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.945 1.698 . . . . 0.0 110.86 -176.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . 0.575 ' OE2' HD23 ' A' ' 113' ' ' LEU . 2.4 pt-20 -61.91 -86.41 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 154.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.493 ' CD2' ' HB2' ' A' ' 116' ' ' GLU . 98.7 m-85 -90.82 18.57 6.37 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.724 0.773 . . . . 0.0 110.233 -162.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -147.23 100.18 3.24 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 174.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -132.33 -33.56 1.28 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.8 t -130.95 143.31 50.63 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 120.827 1.649 . . . . 0.0 110.441 -168.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -62.14 -36.59 82.26 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 119.756 -1.84 . . . . 0.0 112.334 -171.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 26.9 t -62.52 -20.1 64.28 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 117.23 -1.367 . . . . 0.0 112.934 176.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -66.32 -23.37 66.35 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 121.046 1.748 . . . . 0.0 111.508 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.7 mttt -60.61 -6.35 1.63 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 126.335 1.854 . . . . 0.0 113.342 -175.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -104.56 -8.82 18.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 122.903 1.335 . . . . 0.0 114.122 -176.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.95 -62.66 1.56 Allowed 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 127.272 2.229 . . . . 0.0 108.916 176.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.8 t -57.69 -42.77 82.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 124.409 1.084 . . . . 0.0 111.467 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -76.27 -13.79 60.15 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 171.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -79.47 -41.72 26.87 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 125.051 1.34 . . . . 0.0 112.849 -179.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -59.02 -29.23 67.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.912 0.485 . . . . 0.0 110.29 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.3 t -67.03 -26.82 37.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 123.926 0.89 . . . . 0.0 111.437 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -96.96 -16.46 20.62 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.82 0.736 . . . . 0.0 111.849 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.43 -7.38 76.13 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.705 0.684 . . . . 0.0 112.878 -179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -84.81 176.19 8.67 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.902 1.281 . . . . 0.0 109.757 167.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -139.06 165.85 26.05 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 127.101 2.16 . . . . 0.0 108.368 -175.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.11 21.52 6.26 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.838 0.855 . . . . 0.0 110.459 178.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 . . . . . 0 C--O 1.251 1.153 0 C-N-CA 129.839 3.256 . . . . 0.0 110.249 -160.288 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 . . . . . 0 CA--C 1.542 0.673 0 CA-C-O 121.287 0.565 . . . . 0.0 109.498 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.6 146.6 48.11 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 128.075 2.55 . . . . 0.0 106.143 171.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -55.86 -39.89 72.13 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.867 0.467 . . . . 0.0 110.45 -171.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -45.48 94.56 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.175 0.898 . . . . 0.0 110.511 -176.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.5 mm-40 -61.01 -34.93 75.59 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 124.835 1.254 . . . . 0.0 110.817 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 96.6 mt -74.05 -41.14 52.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 C-N-CA 124.517 1.127 . . . . 0.0 109.748 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.58 -42.49 90.49 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 124.967 1.27 . . . . 0.0 111.797 -175.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.3 t -60.82 -45.45 97.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-N 117.107 0.454 . . . . 0.0 110.742 176.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 46.1 mt -63.61 -45.37 90.61 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.933 0.788 . . . . 0.0 109.593 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.54 -47.45 73.16 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.386 1.075 . . . . 0.0 110.251 176.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.41 -22.67 78.81 Favored Glycine 0 CA--C 1.523 0.579 0 O-C-N 121.696 -0.627 . . . . 0.0 112.504 178.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 38' ' ' PRO . 2.1 tp -69.61 -17.79 63.56 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.052 1.926 . . . . 0.0 112.207 174.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.438 ' HB2' ' HE2' ' A' ' 117' ' ' PHE . . . -91.26 -20.88 21.43 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 117.012 -1.47 . . . . 0.0 113.083 170.111 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.5 mp -134.28 105.58 6.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 -176.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.287 2.3 p 57.31 62.06 5.9 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.665 1.986 . . . . 0.0 112.141 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.421 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 39.0 Cg_endo -67.41 -42.14 7.82 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.914 3.076 . . . . 0.0 111.016 176.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.57 -51.38 63.05 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -172.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -45.62 -48.13 14.7 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.873 0.869 . . . . 0.0 111.194 168.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.7 -52.59 63.69 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 -175.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -64.38 -32.99 74.82 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.132 0.973 . . . . 0.0 112.321 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -62.42 -52.06 65.05 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 119.887 1.221 . . . . 0.0 108.29 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -66.55 -37.44 84.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 117.972 -1.013 . . . . 0.0 111.875 -176.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 31.5 mm -59.19 -51.04 77.26 Favored 'Isoleucine or valine' 0 C--N 1.342 0.26 0 CA-C-N 119.777 1.171 . . . . 0.0 109.441 172.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.38 -38.14 79.74 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.992 0.815 . . . . 0.0 111.068 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.07 -8.3 55.12 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.299 1.04 . . . . 0.0 113.134 176.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 48.05 37.47 7.89 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.62 1.568 . . . . 0.0 112.016 -166.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.5 -6.66 21.56 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.456 1.502 . . . . 0.0 112.288 -177.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.26 128.85 35.88 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -173.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.6 t -114.31 156.49 15.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 174.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -123.31 145.25 48.87 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 127.423 2.289 . . . . 0.0 106.777 176.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -158.01 175.11 35.3 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 121.76 0.644 . . . . 0.0 113.451 -178.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mm -123.02 135.92 61.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.599 0 CA-C-O 124.808 2.242 . . . . 0.0 107.423 177.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.599 HG12 HG11 ' A' ' 61' ' ' VAL . 0.8 OUTLIER -68.03 -59.18 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.809 0 C-N-CA 131.282 3.833 . . . . 0.0 109.817 -177.346 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 56.52 165.23 0.07 OUTLIER Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 127.681 2.392 . . . . 0.0 113.34 -170.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.25 80.54 1.01 Allowed 'Trans proline' 0 N--CA 1.448 -1.182 0 N-CA-C 107.528 -1.758 . . . . 0.0 107.528 155.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.5 t -159.1 -72.72 0.08 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.309 -1.738 . . . . 0.0 106.309 162.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.89 160.84 7.18 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 123.525 0.73 . . . . 0.0 112.611 -164.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 m -66.42 112.03 3.85 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 172.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.599 HG11 HG12 ' A' ' 55' ' ' VAL . 8.5 m -140.0 160.58 59.89 Favored Pre-proline 0 C--O 1.238 0.488 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 178.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.28 168.02 18.84 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.37 2.047 . . . . 0.0 110.794 171.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.11 132.86 49.48 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 171.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 99.7 37.32 3.99 Favored Glycine 0 CA--C 1.492 -1.395 0 CA-C-O 118.399 -1.223 . . . . 0.0 114.198 170.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.873 HG23 ' HB2' ' A' ' 68' ' ' TYR 0.296 1.6 p -174.1 56.17 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 CA-C-O 123.018 1.39 . . . . 0.0 107.701 -168.175 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -86.76 -4.52 59.19 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.732 1.613 . . . . 0.0 112.011 177.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -164.51 20.48 0.06 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.031 2.132 . . . . 0.0 110.719 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.873 ' HB2' HG23 ' A' ' 65' ' ' VAL . 4.5 m-85 -83.69 100.18 10.71 Favored 'General case' 0 CA--C 1.52 -0.185 0 C-N-CA 126.128 1.771 . . . . 0.0 109.241 174.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -44.2 139.96 2.36 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 127.096 2.158 . . . . 0.0 111.86 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.408 ' HD2' HG13 ' A' ' 55' ' ' VAL . 47.0 p90 -127.12 166.93 16.72 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.485 1.114 . . . . 0.0 112.731 -175.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 19.1 mt -139.16 124.9 19.59 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 127.387 2.275 . . . . 0.0 106.347 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -150.59 143.47 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 126.138 1.775 . . . . 0.0 106.463 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.1 156.15 34.11 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 169.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.95 -24.32 62.44 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -174.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -111.46 3.73 18.33 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.434 1.894 . . . . 0.0 110.952 -174.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -101.27 19.82 16.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.203 1.801 . . . . 0.0 111.23 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -44.97 -43.34 8.99 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 126.532 1.933 . . . . 0.0 113.693 -169.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -124.99 13.78 8.46 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.662 1.185 . . . . 0.0 111.479 170.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.67 -68.65 1.52 Allowed Glycine 0 CA--C 1.522 0.518 0 C-N-CA 126.215 1.864 . . . . 0.0 110.209 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.4 m -148.91 156.98 43.08 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.861 0.864 . . . . 0.0 108.805 179.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.5 tt -155.88 159.79 2.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 172.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.595 HG23 ' HB3' ' A' ' 95' ' ' TYR . 9.7 mt -134.93 157.04 40.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 166.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.462 ' CD2' HG21 ' A' ' 65' ' ' VAL . 81.1 m-85 -133.13 155.97 48.29 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.122 2.569 . . . . 0.0 107.624 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -164.79 160.45 19.62 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.472 -1.393 . . . . 0.0 109.29 175.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.473 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -149.11 127.45 12.19 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 169.78 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.56 117.67 19.96 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 164.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -100.28 22.28 11.77 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.58 1.552 . . . . 0.0 109.703 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 86.58 121.09 1.3 Allowed Glycine 0 C--N 1.34 0.78 0 C-N-CA 125.324 1.44 . . . . 0.0 110.417 -177.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 50.82 1.01 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.656 2.382 . . . . 0.0 116.385 -171.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -151.5 145.27 25.06 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 126.028 1.731 . . . . 0.0 107.112 -162.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 68.0 t -138.4 108.63 4.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 125.119 1.368 . . . . 0.0 108.075 -175.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.415 HD12 ' H ' ' A' ' 92' ' ' ILE . 4.5 mp -77.88 104.62 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 162.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 34.2 mt -76.98 135.15 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 106.212 -1.773 . . . . 0.0 106.212 165.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -126.74 103.07 7.34 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.628 1.571 . . . . 0.0 109.825 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.595 ' HB3' HG23 ' A' ' 82' ' ' ILE . 40.6 p90 -119.72 165.56 14.36 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.067 -1.646 . . . . 0.0 111.322 -174.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.6 t -156.9 169.97 23.56 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.588 1.555 . . . . 0.0 108.019 171.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 m -109.86 -9.05 14.81 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.19 1.396 . . . . 0.0 111.114 172.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -136.0 112.82 10.22 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.5 1.52 . . . . 0.0 108.586 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -48.44 -32.89 8.38 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 126.188 1.795 . . . . 0.0 112.583 175.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . 0.296 0.0 OUTLIER -79.29 3.77 17.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.132 1.901 . . . . 0.0 116.132 178.051 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.2 p -120.3 165.75 14.44 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 119.078 0.854 . . . . 0.0 111.168 -178.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -66.26 158.01 30.07 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.341 0.591 . . . . 0.0 110.247 -174.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 61.2 mt -91.38 142.7 27.4 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.475 0.71 . . . . 0.0 109.457 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.08 173.08 0.87 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.348 0.659 . . . . 0.0 109.533 164.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.62 112.66 9.09 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.549 1.14 . . . . 0.0 108.199 170.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.2 tptt -123.03 97.69 5.55 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 105.314 -2.106 . . . . 0.0 105.314 178.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.94 126.57 35.45 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 178.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -123.3 157.94 32.09 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.895 1.278 . . . . 0.0 108.179 174.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.3 158.87 33.24 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.346 -0.846 . . . . 0.0 110.145 162.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 17.2 mt -47.13 -54.49 10.41 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.168 0.987 . . . . 0.0 109.665 162.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.27 -30.84 70.71 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 117.138 -1.41 . . . . 0.0 112.116 -174.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -62.79 -57.83 9.55 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 120.073 1.306 . . . . 0.0 109.867 173.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 92.8 mt -55.64 -32.14 62.92 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.463 0.574 . . . . 0.0 111.376 -178.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.8 tttm -70.64 -47.03 62.11 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 118.677 -0.678 . . . . 0.0 111.635 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -50.83 71.83 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 119.155 0.889 . . . . 0.0 108.773 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -57.36 -62.38 1.81 Allowed 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 124.882 1.273 . . . . 0.0 109.025 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . 0.438 ' HE2' ' HB2' ' A' ' 35' ' ' ALA . 19.2 m-85 -127.99 13.38 6.77 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -157.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -143.77 58.03 1.36 Allowed 'General case' 0 C--O 1.24 0.586 0 O-C-N 119.792 -1.818 . . . . 0.0 109.901 173.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.627 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -108.47 -34.69 6.69 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.825 -168.39 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.2 t -107.55 148.05 29.75 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 125.297 1.439 . . . . 0.0 110.294 -173.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -60.82 -28.97 69.2 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.684 -1.26 . . . . 0.0 110.756 175.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.97 -39.22 74.18 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 119.589 1.086 . . . . 0.0 111.243 176.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.627 HE22 ' NE2' ' A' ' 119' ' ' GLN . 0.0 OUTLIER -61.95 -18.52 60.64 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 179.611 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -78.32 -2.46 38.2 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.659 178.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.87 -79.71 0.2 Allowed 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 153.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -52.11 -61.88 1.99 Allowed 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -160.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 76.0 t -55.8 -36.94 45.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 118.534 0.606 . . . . 0.0 110.559 -176.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -77.34 -30.22 53.85 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.999 1.32 . . . . 0.0 111.896 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.41 -49.76 74.2 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 126.009 1.724 . . . . 0.0 109.394 164.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -59.25 -38.77 80.88 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.769 0.713 . . . . 0.0 110.543 -176.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 90.1 t -64.3 -33.26 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 118.983 0.811 . . . . 0.0 111.08 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -86.38 -23.35 26.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 118.86 0.755 . . . . 0.0 112.53 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.88 -32.19 13.4 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 125.003 1.287 . . . . 0.0 111.825 -176.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.3 pp -56.5 125.5 22.35 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 166.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -79.73 167.37 20.72 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 9.9 m -134.43 6.64 3.55 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 120.353 -1.467 . . . . 0.0 111.398 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.921 0 C-N-CA 127.719 2.408 . . . . 0.0 104.774 163.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.442 ' CZ ' ' HE3' ' A' ' 114' ' ' LYS . 4.5 m-85 . . . . . 0 CA--C 1.548 0.896 0 CA-C-O 121.109 0.481 . . . . 0.0 110.983 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.3 p -138.53 150.26 46.19 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.787 2.035 . . . . 0.0 107.326 171.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -59.4 -41.72 90.1 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.423 0.556 . . . . 0.0 110.106 -174.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.61 HE22 HD11 ' A' ' 134' ' ' LEU . 2.5 mm100 -44.44 -56.04 4.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.385 1.874 . . . . 0.0 111.433 169.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -69.43 -30.86 68.89 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.904 1.282 . . . . 0.0 112.605 -174.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.491 HG21 ' HB2' ' A' ' 86' ' ' ALA . 48.2 mt -80.2 -34.96 15.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 C-N-CA 123.22 0.608 . . . . 0.0 109.821 -179.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.403 ' CA ' ' CZ ' ' A' ' 84' ' ' PHE . . . -55.73 -44.97 86.69 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 124.048 0.832 . . . . 0.0 112.055 -173.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.6 t -56.02 -50.49 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 118.306 1.053 . . . . 0.0 109.321 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 53.4 mt -58.26 -39.31 78.87 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.334 0.97 . . . . 0.0 110.832 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.13 -47.35 80.27 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 118.879 -0.581 . . . . 0.0 111.816 176.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.71 -29.27 72.73 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.976 0.807 . . . . 0.0 111.378 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.8 mt -62.08 -28.31 69.52 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 120.356 -1.673 . . . . 0.0 110.62 172.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.26 -12.99 59.95 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 117.111 -1.423 . . . . 0.0 113.094 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.0 mm -143.64 98.95 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 125.799 1.64 . . . . 0.0 107.309 -173.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t 56.71 68.65 2.06 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 124.836 1.254 . . . . 0.0 112.083 -175.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.32 -37.87 69.44 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.328 2.018 . . . . 0.0 110.711 176.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -47.01 77.74 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 118.185 -0.912 . . . . 0.0 112.078 -173.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 59.4 t90 -52.93 -52.94 56.13 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tt -58.15 -52.0 67.38 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 121.454 -0.779 . . . . 0.0 110.929 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -57.83 -35.17 70.51 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 118.574 -0.727 . . . . 0.0 111.123 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -69.66 -50.7 41.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 178.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -59.19 -38.41 79.76 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.354 -0.831 . . . . 0.0 112.305 -177.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 31.4 mm -60.53 -53.19 52.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 119.319 0.963 . . . . 0.0 109.36 173.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.65 -41.2 81.0 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 117.836 0.289 . . . . 0.0 110.749 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.53 -17.66 63.6 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.505 1.522 . . . . 0.0 113.141 176.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.1 t30 59.02 30.05 19.77 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.641 1.577 . . . . 0.0 110.838 -169.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.405 HE21 ' HA ' ' A' ' 49' ' ' GLN . 4.1 mm-40 -94.22 -16.65 23.46 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.879 1.272 . . . . 0.0 112.703 -177.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.57 135.7 35.57 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.439 1.496 . . . . 0.0 109.59 -169.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 45.8 t -122.15 145.69 28.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 124.759 1.224 . . . . 0.0 108.004 170.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -106.31 136.22 46.42 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 128.049 2.54 . . . . 0.0 106.683 173.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -153.36 178.65 30.27 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-O 122.9 1.278 . . . . 0.0 113.697 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 26.8 mm -130.49 137.82 55.27 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.932 0 C-N-CA 127.981 2.512 . . . . 0.0 108.14 -171.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.605 HG12 HG11 ' A' ' 61' ' ' VAL 0.255 2.8 m -70.59 -75.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.409 -2.503 0 CA-C-N 108.823 -3.808 . . . . 0.0 108.675 179.398 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp 55.39 167.39 0.05 OUTLIER Pre-proline 0 C--N 1.349 0.543 0 C-N-CA 125.301 1.44 . . . . 0.0 111.573 -173.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -66.84 73.18 0.44 Allowed 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 121.719 1.613 . . . . 0.0 110.375 164.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.3 t -153.16 -63.67 0.15 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.826 1.25 . . . . 0.0 112.65 175.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.68 175.73 9.08 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 120.566 1.53 . . . . 0.0 110.935 -172.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 t -93.69 121.15 34.83 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 -179.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.605 HG11 HG12 ' A' ' 55' ' ' VAL . 4.8 m -150.42 160.8 32.28 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 123.957 0.903 . . . . 0.0 109.011 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -71.5 158.92 52.79 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.937 1.758 . . . . 0.0 111.092 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.19 129.55 40.62 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 173.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.64 22.99 9.72 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 117.461 -1.744 . . . . 0.0 114.824 174.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.2 m -141.2 70.01 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.8 1.8 . . . . 0.0 110.1 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -85.3 -11.49 54.58 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.923 1.689 . . . . 0.0 114.61 -172.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -170.44 25.68 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 126.266 1.826 . . . . 0.0 109.506 -166.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.431 ' CD1' ' HB2' ' A' ' 85' ' ' LYS . 3.5 m-85 -94.98 105.75 17.69 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.687 1.595 . . . . 0.0 107.426 176.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.08 150.11 4.66 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 118.99 0.813 . . . . 0.0 110.69 172.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -130.73 158.46 40.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.174 0.59 . . . . 0.0 111.03 -176.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -120.63 128.48 53.05 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 127.096 2.158 . . . . 0.0 106.98 174.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -153.22 159.62 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 173.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.419 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -89.78 161.45 16.02 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.371 0.605 . . . . 0.0 110.407 176.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.8 -5.59 4.5 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.106 0.962 . . . . 0.0 113.52 172.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -140.3 22.63 2.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.659 0.784 . . . . 0.0 110.972 -175.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.419 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 19.7 m-20 -127.0 29.18 5.66 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.407 1.883 . . . . 0.0 109.407 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -63.61 -5.33 3.81 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 119.252 -2.155 . . . . 0.0 114.33 -177.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -143.19 22.49 1.88 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.093 1.357 . . . . 0.0 111.511 160.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.12 -71.83 1.31 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 125.634 1.587 . . . . 0.0 111.198 -176.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 21.4 m -145.29 160.78 40.99 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.206 1.802 . . . . 0.0 107.572 177.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tt -152.4 155.04 7.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 168.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 16.2 mt -130.76 140.52 48.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 166.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -114.83 146.82 40.64 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.326 1.85 . . . . 0.0 109.2 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . 0.403 ' CZ ' ' CA ' ' A' ' 29' ' ' GLY . 45.1 p90 -151.59 156.74 41.07 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.126 -0.984 . . . . 0.0 110.92 172.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.431 ' HB2' ' CD1' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -148.57 90.29 1.77 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.859 2.064 . . . . 0.0 110.248 178.836 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.491 ' HB2' HG21 ' A' ' 28' ' ' ILE . . . -72.36 104.42 3.74 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 119.287 -0.965 . . . . 0.0 109.006 172.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.14 128.83 55.34 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 125.666 1.586 . . . . 0.0 108.265 174.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 57.19 -89.23 0.01 OUTLIER Glycine 0 CA--C 1.528 0.875 0 C-N-CA 125.035 1.302 . . . . 0.0 111.735 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.486 ' HA ' HD12 ' A' ' 110' ' ' LEU . 17.6 mp0 -137.85 17.21 2.86 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.421 2.688 . . . . 0.0 112.024 -174.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 88.6 m -137.29 142.3 41.93 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.981 1.712 . . . . 0.0 110.154 -172.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.8 t -128.36 100.72 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 126.566 1.947 . . . . 0.0 107.04 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.633 HD12 ' H ' ' A' ' 92' ' ' ILE . 3.3 mp -72.44 77.62 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 130.091 3.357 . . . . 0.0 109.198 165.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mt -65.14 129.85 29.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 173.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -128.47 121.3 28.61 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.533 1.133 . . . . 0.0 108.073 -176.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -145.21 169.54 18.01 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 121.122 -0.986 . . . . 0.0 110.72 -168.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.5 t -157.01 174.45 15.5 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.623 0.725 . . . . 0.0 111.29 -171.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.2 p -106.58 -8.99 16.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.615 1.166 . . . . 0.0 112.056 165.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -144.42 147.57 33.53 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.68 0.792 . . . . 0.0 111.827 -175.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.9 ttt-85 -81.57 10.94 5.13 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.582 1.153 . . . . 0.0 112.088 173.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -116.86 3.74 12.91 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.418 1.487 . . . . 0.0 114.039 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 34.4 p -130.27 176.1 8.39 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.75 0.82 . . . . 0.0 112.702 -166.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.73 148.56 44.55 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.027 1.331 . . . . 0.0 109.061 172.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 84.9 mt -86.42 142.12 28.65 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 126.434 1.894 . . . . 0.0 108.872 175.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -64.37 168.81 5.28 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.276 1.03 . . . . 0.0 109.841 167.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -129.43 103.72 7.07 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.274 1.43 . . . . 0.0 109.55 -179.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.1 tptt -122.29 92.16 3.66 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -82.01 120.25 25.02 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 171.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.12 145.49 45.91 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 126.737 2.015 . . . . 0.0 106.674 168.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 2.4 p -67.37 157.59 33.69 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 121.536 -0.727 . . . . 0.0 111.207 173.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 89' ' ' GLN . 13.1 mt -51.87 -46.04 64.33 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 121.823 -0.548 . . . . 0.0 110.493 166.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.26 -41.01 98.99 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 117.194 -1.384 . . . . 0.0 111.081 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -62.39 1.64 Allowed 'General case' 0 C--N 1.345 0.41 0 CA-C-N 119.402 1.001 . . . . 0.0 109.382 174.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 56.7 mt -60.97 -38.27 85.35 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -174.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.442 ' HE3' ' CZ ' ' A' ' 23' ' ' PHE . 1.9 ttmp? -62.99 -43.1 99.72 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 118.849 -0.596 . . . . 0.0 109.77 176.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -56.38 13.94 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.491 1.041 . . . . 0.0 108.354 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -51.69 -42.12 61.94 Favored 'General case' 0 C--O 1.23 0.075 0 C-N-CA 124.929 1.292 . . . . 0.0 111.899 -174.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -132.01 20.39 4.52 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.8 0.44 . . . . 0.0 112.135 -165.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -161.99 61.43 0.24 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 122.125 0.964 . . . . 0.0 111.082 176.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.674 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -103.27 -47.85 4.19 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.016 0.926 . . . . 0.0 111.697 179.611 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . 0.525 ' H ' HE21 ' A' ' 123' ' ' GLN . 80.8 p -88.5 161.49 16.96 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 121.246 -0.909 . . . . 0.0 110.137 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -83.06 -32.2 26.94 Favored 'General case' 0 C--N 1.334 -0.104 0 O-C-N 121.807 -0.558 . . . . 0.0 110.599 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.88 -37.09 80.98 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.981 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.674 HE22 ' NE2' ' A' ' 119' ' ' GLN . 2.8 pt20 -65.92 -29.16 69.53 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.972 1.26 . . . . 0.0 111.793 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -56.38 -34.34 66.58 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 118.741 -0.647 . . . . 0.0 112.328 -172.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.56 -71.14 0.08 Allowed 'General case' 0 C--O 1.215 -0.739 0 C-N-CA 125.566 1.546 . . . . 0.0 108.155 174.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -47.9 -57.81 5.21 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 124.165 0.986 . . . . 0.0 112.585 178.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 92.3 t -55.95 -41.92 69.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.636 -174.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -77.76 -28.68 50.71 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.787 0.721 . . . . 0.0 112.091 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -58.91 -44.65 91.32 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 169.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -58.75 -28.48 65.92 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.225 0.61 . . . . 0.0 111.05 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.71 -14.22 18.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 123.609 0.764 . . . . 0.0 111.628 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -123.0 -12.36 7.98 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 120.174 1.352 . . . . 0.0 112.858 178.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -79.89 -21.08 66.59 Favored Glycine 0 CA--C 1.525 0.665 0 O-C-N 121.466 -0.771 . . . . 0.0 111.269 168.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.61 HD11 HE22 ' A' ' 26' ' ' GLN . 4.4 pp -68.52 141.04 55.65 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.369 1.085 . . . . 0.0 108.118 162.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -88.69 170.26 10.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 169.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 8.5 m -130.92 9.26 4.89 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.821 -1.175 . . . . 0.0 110.215 172.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 C--O 1.236 0.375 0 C-N-CA 128.24 2.616 . . . . 0.0 104.48 172.791 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 . . . . . 0 C--O 1.234 0.254 0 CA-C-O 122.375 1.083 . . . . 0.0 109.255 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -137.17 155.97 48.91 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 126.929 2.092 . . . . 0.0 107.243 -170.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -49.68 -49.22 48.39 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.444 1.098 . . . . 0.0 110.722 175.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -44.82 -56.9 4.1 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.319 1.448 . . . . 0.0 112.332 172.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -70.92 -39.24 72.82 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.276 1.03 . . . . 0.0 110.602 -171.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 79.2 mt -64.86 -31.72 55.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.247 1.019 . . . . 0.0 109.237 175.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -49.44 -55.22 13.68 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 125.759 1.647 . . . . 0.0 111.843 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.0 t -68.31 -39.39 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 119.026 -0.512 . . . . 0.0 109.64 -173.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.9 mp -62.0 -52.74 62.78 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.908 0.776 . . . . 0.0 111.034 177.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.19 -31.43 72.57 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.574 0.625 . . . . 0.0 111.049 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.5 -27.24 70.56 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 118.637 0.653 . . . . 0.0 112.988 172.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.25 -27.45 60.77 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.977 1.889 . . . . 0.0 112.098 177.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.8 -25.92 64.93 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.891 170.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.1 mm -130.86 87.44 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 124.601 1.16 . . . . 0.0 108.68 -166.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.96 60.29 0.62 Allowed Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.009 1.324 . . . . 0.0 111.552 172.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -57.94 -37.52 95.79 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 123.236 2.624 . . . . 0.0 111.601 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -60.07 -41.66 92.89 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.376 0.67 . . . . 0.0 111.434 -178.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 37.1 t90 -61.16 -57.64 11.64 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 tt -50.25 -48.26 54.81 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.529 0.732 . . . . 0.0 110.337 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -63.95 -45.4 89.35 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.836 0.854 . . . . 0.0 111.376 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -59.89 -40.41 88.63 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.93 0.786 . . . . 0.0 111.208 173.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -63.68 -54.34 37.05 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -178.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 30.0 mm -55.49 -41.72 64.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.407 1.083 . . . . 0.0 109.691 178.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.84 7.21 1.64 Allowed 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.35 21.71 2.96 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.364 -0.835 . . . . 0.0 110.731 159.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.2 t30 50.95 25.0 2.02 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.373 2.269 . . . . 0.0 112.96 -175.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -81.24 -15.23 56.22 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 119.909 -1.744 . . . . 0.0 112.721 -174.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 tp -69.45 133.64 47.98 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 119.459 1.027 . . . . 0.0 109.044 -175.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.8 t -112.91 154.79 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 106.257 -1.757 . . . . 0.0 106.257 169.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -123.0 145.97 48.04 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 128.394 2.678 . . . . 0.0 107.209 173.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -162.86 171.13 38.58 Favored Glycine 0 C--N 1.332 0.348 0 O-C-N 121.166 -0.959 . . . . 0.0 113.687 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 31.4 mm -114.98 133.38 61.33 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.595 0 C-N-CA 126.804 2.042 . . . . 0.0 106.417 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.534 ' HA ' HG11 ' A' ' 61' ' ' VAL . 0.5 OUTLIER -44.5 -54.21 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.589 1 C-N-CA 133.237 4.615 . . . . 0.0 112.266 169.271 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 19.8 mttt 62.89 159.65 0.12 Allowed Pre-proline 0 CA--C 1.536 0.421 0 C-N-CA 126.666 1.987 . . . . 0.0 112.971 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -70.75 -12.28 30.79 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.324 2.682 . . . . 0.0 113.278 -178.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 47.8 m -149.55 90.69 1.74 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.366 1.466 . . . . 0.0 107.795 170.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -138.92 -165.16 1.78 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 156.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.7 t -92.71 36.76 1.01 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.336 1.454 . . . . 0.0 112.585 -170.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.534 HG11 ' HA ' ' A' ' 55' ' ' VAL . 9.5 m -105.73 153.24 40.1 Favored Pre-proline 0 C--N 1.324 -0.539 0 C-N-CA 123.43 0.692 . . . . 0.0 109.252 -167.229 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.99 178.04 4.47 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.998 2.465 . . . . 0.0 111.311 -174.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.92 160.04 24.8 Favored 'General case' 0 C--O 1.238 0.482 0 O-C-N 121.185 -0.947 . . . . 0.0 109.35 170.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.9 33.74 65.81 Favored Glycine 0 CA--C 1.529 0.967 0 CA-C-O 119.615 -0.547 . . . . 0.0 112.117 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.2 m -146.34 25.38 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 125.923 1.689 . . . . 0.0 110.398 176.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.47 -5.14 0.3 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 127.778 2.431 . . . . 0.0 116.674 -164.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -157.57 15.98 0.25 Allowed 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 127.187 2.195 . . . . 0.0 109.883 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.491 ' CE2' ' HE3' ' A' ' 94' ' ' LYS . 5.6 m-85 -86.98 100.83 12.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.23 148.6 8.24 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.685 0.675 . . . . 0.0 110.076 174.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 46.6 p90 -123.38 166.78 14.76 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.422 1.089 . . . . 0.0 111.244 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 31.2 mt -136.27 130.46 33.03 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 127.564 2.346 . . . . 0.0 105.282 176.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.1 p -148.96 151.77 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 176.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -86.49 143.89 27.52 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.56 1.073 . . . . 0.0 109.003 176.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.19 -10.26 4.3 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 128.246 2.618 . . . . 0.0 114.604 -171.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.83 7.05 4.37 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.804 1.241 . . . . 0.0 111.609 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -134.58 31.82 3.37 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.188 1.795 . . . . 0.0 107.215 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -67.87 -18.69 64.89 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.449 1.5 . . . . 0.0 113.116 -166.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.75 20.66 12.24 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.59 1.956 . . . . 0.0 109.471 174.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.2 -98.36 2.56 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 126.535 2.017 . . . . 0.0 109.478 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.4 m -74.58 162.28 28.92 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.603 1.161 . . . . 0.0 108.57 169.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.9 tt -161.42 154.83 3.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 O-C-N 121.005 -1.059 . . . . 0.0 108.741 153.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.54 HG23 ' HB3' ' A' ' 95' ' ' TYR . 3.6 mt -138.34 147.77 25.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 175.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -133.39 156.66 47.26 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 127.894 2.477 . . . . 0.0 108.567 -174.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -162.7 159.61 24.54 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.408 -1.432 . . . . 0.0 111.174 174.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.52 115.88 6.2 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.94 1.296 . . . . 0.0 109.875 176.3 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.544 ' HA ' HG22 ' A' ' 91' ' ' VAL . . . -70.26 96.84 1.15 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.712 0.805 . . . . 0.0 109.482 167.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -64.18 -17.23 63.32 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.867 -0.587 . . . . 0.0 111.052 163.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 100.78 122.61 4.99 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 108.409 -1.876 . . . . 0.0 108.409 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 60.35 -7.14 0.08 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.067 1.747 . . . . 0.0 113.614 -161.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.07 146.29 36.96 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 128.148 2.579 . . . . 0.0 107.861 178.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.544 HG22 ' HA ' ' A' ' 86' ' ' ALA . 41.2 t -132.82 114.32 21.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 172.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.421 ' N ' HD12 ' A' ' 92' ' ' ILE . 2.8 mp -79.71 105.25 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 N-CA-C 104.544 -2.391 . . . . 0.0 104.544 171.455 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 2.9 mt -77.32 142.09 14.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 106.359 -1.719 . . . . 0.0 106.359 169.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.491 ' HE3' ' CE2' ' A' ' 68' ' ' TYR . 88.6 mttt -132.13 123.52 27.28 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.904 1.281 . . . . 0.0 108.615 171.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.54 ' HB3' HG23 ' A' ' 82' ' ' ILE . 43.7 p90 -142.22 166.76 23.81 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.901 -1.124 . . . . 0.0 111.126 -176.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.4 t -154.19 175.83 13.0 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 124.523 1.129 . . . . 0.0 109.259 -172.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 93.2 p -119.78 3.84 11.06 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.273 1.029 . . . . 0.0 111.811 166.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -137.85 141.64 40.75 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 157.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -50.7 -42.47 57.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.56 1.144 . . . . 0.0 109.972 174.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -95.04 24.82 4.57 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 129.066 2.946 . . . . 0.0 113.454 -173.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 67.7 p -126.74 159.12 34.66 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.793 1.633 . . . . 0.0 109.359 170.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -64.87 130.26 42.79 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 121.372 -0.83 . . . . 0.0 110.019 -174.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.45 152.38 34.52 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.243 1.817 . . . . 0.0 110.815 177.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -73.75 174.88 7.79 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.919 1.688 . . . . 0.0 109.804 168.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -119.24 132.33 55.91 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.049 1.339 . . . . 0.0 109.145 168.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.01 130.41 17.71 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 167.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -140.53 92.16 2.49 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 119.829 1.195 . . . . 0.0 109.586 -167.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.05 166.45 11.23 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.045 0.938 . . . . 0.0 109.203 -174.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 42.0 p -84.93 161.99 19.61 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 123.088 0.555 . . . . 0.0 112.043 177.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.8 mt -57.78 -40.1 79.02 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 174.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.45 -37.0 82.3 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 116.238 -1.839 . . . . 0.0 111.554 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.28 -63.83 1.0 Allowed 'General case' 0 C--N 1.347 0.496 0 CA-C-N 121.64 2.018 . . . . 0.0 110.746 169.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 29.2 mt -55.84 -34.36 65.34 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.214 0.531 . . . . 0.0 110.893 -175.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -71.17 -40.4 71.31 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.148 0.579 . . . . 0.0 111.174 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.77 -14.64 61.58 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 124.646 1.178 . . . . 0.0 112.236 176.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -101.08 -41.76 6.64 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 123.456 0.703 . . . . 0.0 110.227 -173.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -130.98 -0.5 4.17 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -168.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.476 ' C ' HE22 ' A' ' 123' ' ' GLN . 4.4 t80 -136.11 54.77 1.88 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 122.912 1.339 . . . . 0.0 110.617 -176.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -88.25 -59.04 2.35 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 127.561 2.344 . . . . 0.0 114.728 174.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.9 p -77.57 -166.96 0.84 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.882 1.673 . . . . 0.0 111.886 -164.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.24 -51.16 3.01 Favored 'General case' 0 CA--C 1.522 -0.103 0 C-N-CA 124.701 1.201 . . . . 0.0 108.604 -178.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.6 t -57.65 -30.44 65.41 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.262 1.825 . . . . 0.0 112.041 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.476 HE22 ' C ' ' A' ' 118' ' ' TYR . 10.5 pt20 -53.68 -32.4 51.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.668 1.576 . . . . 0.0 111.559 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -68.37 0.42 3.92 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 125.108 1.363 . . . . 0.0 112.361 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -108.78 0.19 20.28 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.566 1.546 . . . . 0.0 111.325 175.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -121.4 -64.7 1.2 Allowed 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 125.538 1.535 . . . . 0.0 107.478 173.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 21.9 t -52.23 -47.31 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.468 1.507 . . . . 0.0 111.056 -178.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -67.94 -32.31 72.66 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.35 0.871 . . . . 0.0 113.35 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -75.97 -35.02 59.81 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 126.672 1.989 . . . . 0.0 110.594 -172.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -60.89 -33.96 73.92 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 127.678 2.391 . . . . 0.0 111.172 171.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 52.7 t -66.37 -22.24 29.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 O-C-N 121.317 -0.865 . . . . 0.0 110.689 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -98.04 -12.26 22.08 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.611 1.164 . . . . 0.0 112.413 171.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.6 12.1 66.35 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 125.402 1.477 . . . . 0.0 112.414 178.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.9 pp -119.28 177.27 4.96 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.886 1.674 . . . . 0.0 109.405 174.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -130.65 176.03 8.52 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 127.029 2.132 . . . . 0.0 108.754 -168.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -133.69 -0.67 3.15 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.368 0.985 . . . . 0.0 113.087 -175.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.252 1.197 0 C-N-CA 127.763 2.425 . . . . 0.0 107.104 -155.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 . . . . . 0 N--CA 1.469 0.489 0 CA-C-O 121.199 0.523 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.2 p -110.96 149.64 30.38 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 120.953 -1.092 . . . . 0.0 109.458 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -54.71 -31.02 57.55 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.381 1.472 . . . . 0.0 111.335 -176.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -59.87 -60.1 4.37 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 129.369 3.067 . . . . 0.0 110.742 174.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -69.59 -36.44 76.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.623 1.569 . . . . 0.0 109.473 -172.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 82.9 mt -62.34 -39.49 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.648 0.779 . . . . 0.0 109.131 170.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.21 -55.13 25.87 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 124.747 1.165 . . . . 0.0 111.879 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 50.5 t -61.44 -41.88 91.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.311 1.055 . . . . 0.0 110.51 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.1 mt -62.14 -49.27 76.53 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 118.818 0.735 . . . . 0.0 111.055 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.53 93.2 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.429 0.292 . . . . 0.0 110.967 175.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.85 -32.91 85.75 Favored Glycine 0 C--O 1.222 -0.654 0 CA-C-O 119.07 -0.85 . . . . 0.0 111.634 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.533 HD12 HD21 ' A' ' 41' ' ' LEU . 7.2 mp -65.57 -30.48 71.22 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 120.342 2.071 . . . . 0.0 112.496 177.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.16 -26.17 68.41 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 118.916 -0.564 . . . . 0.0 111.384 175.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.403 HG21 ' HB3' ' A' ' 95' ' ' TYR . 44.6 mm -131.18 99.93 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 C-N-CA 126.208 1.803 . . . . 0.0 106.854 -165.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.278 1.5 p 57.24 56.32 7.77 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.808 174.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -59.14 -38.33 87.15 Favored 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 123.82 3.014 . . . . 0.0 110.185 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -63.14 -46.08 88.92 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 123.997 0.919 . . . . 0.0 110.906 -176.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -57.19 -46.1 83.13 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 172.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.533 HD21 HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -63.21 -50.35 70.63 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 106.463 -1.681 . . . . 0.0 106.463 -172.018 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -63.53 -40.33 96.76 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 125.372 1.469 . . . . 0.0 111.565 -178.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -57.06 -40.48 76.91 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.948 1.249 . . . . 0.0 110.603 175.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -81.03 -39.12 26.32 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 117.2 -1.381 . . . . 0.0 111.141 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 28.3 mm -57.45 -47.0 85.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 121.207 1.821 . . . . 0.0 108.73 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.69 -5.86 9.78 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -176.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.68 15.63 8.75 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.377 1.471 . . . . 0.0 112.495 173.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 66.44 6.7 4.5 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.043 1.737 . . . . 0.0 113.985 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.64 -13.67 56.07 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 120.446 -1.409 . . . . 0.0 112.235 -159.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.92 114.97 27.84 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.704 0.684 . . . . 0.0 110.728 -158.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 38.3 t -95.96 164.46 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 125.137 1.375 . . . . 0.0 108.601 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -143.49 138.28 29.11 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 128.977 2.911 . . . . 0.0 105.343 -176.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -157.68 177.58 34.4 Favored Glycine 0 C--N 1.333 0.407 0 CA-C-N 118.313 0.506 . . . . 0.0 112.346 173.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 15.7 mm -101.4 140.17 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.15 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 164.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.0 t -44.46 -64.54 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 C-N-CA 127.204 2.201 . . . . 0.0 111.469 176.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.4 mttt 57.57 165.53 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.065 1.746 . . . . 0.0 112.037 -170.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -76.69 -11.39 18.5 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 121.714 1.609 . . . . 0.0 112.832 176.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.3 m -97.12 23.93 6.85 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.423 1.489 . . . . 0.0 112.788 -163.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -139.94 -164.88 1.78 Allowed 'General case' 0 C--O 1.241 0.607 0 C-N-CA 127.176 2.191 . . . . 0.0 106.653 176.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 24.8 m -125.45 98.02 5.43 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 120.472 -1.392 . . . . 0.0 109.525 -166.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.2 m -137.57 157.73 73.21 Favored Pre-proline 0 C--O 1.241 0.645 0 C-N-CA 124.002 0.921 . . . . 0.0 113.054 -166.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.3 171.26 10.65 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.621 2.881 . . . . 0.0 110.602 171.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.32 158.19 34.43 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 121.594 -0.691 . . . . 0.0 111.735 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.49 31.32 63.26 Favored Glycine 0 CA--C 1.526 0.744 0 C-N-CA 124.009 0.814 . . . . 0.0 113.01 167.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.6 m -132.94 26.03 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 124.552 1.141 . . . . 0.0 110.317 174.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.97 -10.79 23.46 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 -154.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -151.39 31.76 0.59 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.863 2.065 . . . . 0.0 108.58 174.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -75.11 153.24 38.39 Favored 'General case' 0 C--O 1.232 0.151 0 O-C-N 120.919 -1.113 . . . . 0.0 108.49 173.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.2 m -72.83 154.48 40.6 Favored 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 123.712 0.805 . . . . 0.0 109.014 156.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -138.48 165.95 25.52 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.594 1.158 . . . . 0.0 109.823 167.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.3 mt -140.47 125.78 18.78 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 127.288 2.235 . . . . 0.0 105.504 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -148.23 150.94 13.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 174.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.66 159.26 17.21 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.784 0.802 . . . . 0.0 109.976 178.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.08 -18.03 63.94 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.199 1.0 . . . . 0.0 113.255 -168.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -102.97 -32.25 9.83 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 123.305 0.642 . . . . 0.0 111.536 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.97 9.65 0.52 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 129.038 2.935 . . . . 0.0 112.65 -176.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -56.41 -26.11 52.29 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.611 1.55 . . . . 0.0 113.618 -158.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.83 -5.88 19.43 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.695 1.589 . . . . 0.0 113.66 174.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.53 -93.64 0.88 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.852 1.215 . . . . 0.0 111.75 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.95 171.05 9.56 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.549 0.74 . . . . 0.0 110.133 -170.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tt -173.58 158.65 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 126.494 1.918 . . . . 0.0 106.944 162.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.425 HG23 ' HB3' ' A' ' 95' ' ' TYR . 22.8 mt -134.86 142.53 40.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 166.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -115.38 154.34 29.38 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.974 1.31 . . . . 0.0 108.541 174.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -158.65 148.1 19.19 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 125.349 1.459 . . . . 0.0 108.252 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -140.48 138.17 34.42 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 168.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -89.52 134.96 33.87 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 172.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -130.29 88.15 2.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 127.248 2.219 . . . . 0.0 108.658 174.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.69 -82.5 0.3 Allowed Glycine 0 C--N 1.336 0.541 0 C-N-CA 125.235 1.398 . . . . 0.0 113.078 170.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -123.79 9.93 8.91 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 126.815 2.046 . . . . 0.0 110.95 178.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.7 m -124.14 157.11 35.44 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.324 2.25 . . . . 0.0 108.51 -179.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 80.8 t -132.44 128.51 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.73 2.012 . . . . 0.0 105.882 168.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 20.1 mm -102.35 98.94 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 105.267 -2.123 . . . . 0.0 105.267 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.3 mt -83.44 130.67 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -134.53 91.26 2.76 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.879 1.672 . . . . 0.0 108.606 -175.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.425 ' HB3' HG23 ' A' ' 82' ' ' ILE . 31.0 p90 -108.48 170.36 8.07 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.807 -1.183 . . . . 0.0 111.645 -173.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.4 t -159.01 173.72 16.04 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.899 1.28 . . . . 0.0 110.152 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.9 m -121.7 12.9 10.72 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.08 2.552 . . . . 0.0 111.485 167.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -144.27 127.11 16.29 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 160.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -49.22 -39.34 29.52 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.593 0.757 . . . . 0.0 110.712 170.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -82.75 31.41 0.42 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.155 1.782 . . . . 0.0 113.628 -177.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 45.6 p -139.22 163.36 32.67 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 119.519 -1.988 . . . . 0.0 112.741 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.541 ' HE3' ' HA ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -58.44 153.92 14.87 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.611 1.164 . . . . 0.0 110.028 169.387 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -105.54 156.17 18.48 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.259 1.424 . . . . 0.0 110.789 -169.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.17 179.04 1.66 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.834 1.254 . . . . 0.0 112.0 173.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -123.07 124.9 44.14 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.707 1.203 . . . . 0.0 109.413 168.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -144.76 105.95 4.2 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 103.911 -2.625 . . . . 0.0 103.911 168.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -118.05 109.34 16.33 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -172.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 27.0 mt -125.14 144.56 50.37 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -166.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 15.9 p -68.52 151.7 46.41 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.952 0.796 . . . . 0.0 109.834 172.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 26.8 mt -55.72 -36.0 66.75 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.426 -0.796 . . . . 0.0 111.211 168.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.4 t -61.53 -44.52 96.9 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.021 173.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.83 -60.81 2.85 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.411 1.085 . . . . 0.0 109.891 178.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 48.0 mt -55.91 -33.52 64.74 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 123.07 0.548 . . . . 0.0 111.948 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 -43.9 77.28 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.665 -0.647 . . . . 0.0 109.29 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -25.21 61.46 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.665 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.72 -66.61 0.61 Allowed 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 169.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -117.22 22.98 12.15 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.851 -1.156 . . . . 0.0 112.763 -158.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -151.06 26.55 0.71 Allowed 'General case' 0 C--O 1.239 0.542 0 O-C-N 120.744 -1.223 . . . . 0.0 112.632 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.581 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.6 OUTLIER -67.24 -59.62 3.27 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -172.514 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 17.9 p -77.81 172.03 14.07 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.016 1.327 . . . . 0.0 110.812 -171.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.83 -50.12 8.4 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 171.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -41.21 63.41 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.514 1.126 . . . . 0.0 110.92 -176.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.581 HE22 ' NE2' ' A' ' 119' ' ' GLN . 6.4 tt0 -48.17 -45.57 33.67 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.734 1.214 . . . . 0.0 111.497 178.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -59.34 -20.37 54.1 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.795 1.638 . . . . 0.0 113.49 -169.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -55.0 -70.7 0.1 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 170.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -57.57 -41.97 82.14 Favored 'General case' 0 C--O 1.222 -0.373 0 O-C-N 123.769 0.668 . . . . 0.0 111.467 -174.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 17.7 t -54.21 -59.0 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 O-C-N 123.919 0.762 . . . . 0.0 109.794 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -57.47 -34.04 68.61 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 123.169 0.293 . . . . 0.0 111.238 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -64.52 -42.15 95.95 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.961 1.304 . . . . 0.0 110.958 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -58.78 -45.76 89.1 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.032 -1.043 . . . . 0.0 109.837 171.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 19.0 t -64.74 -31.1 52.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 O-C-N 121.844 -0.535 . . . . 0.0 110.89 179.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -84.84 -15.03 46.13 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.452 1.101 . . . . 0.0 113.181 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -96.94 -32.6 6.41 Favored Glycine 0 C--N 1.334 0.421 0 C-N-CA 124.123 0.868 . . . . 0.0 111.808 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.56 151.52 20.31 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.087 0.944 . . . . 0.0 112.177 -173.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 56.6 mtp85 -92.37 153.26 19.29 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 174.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 m -131.19 25.37 4.89 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.846 1.258 . . . . 0.0 109.635 173.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.917 2.887 . . . . 0.0 110.949 -164.141 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 . . . . . 0 CA--C 1.543 0.695 0 CA-C-O 121.684 0.754 . . . . 0.0 110.433 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -122.35 152.69 39.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.548 1.539 . . . . 0.0 109.534 -175.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.59 -55.62 5.03 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 125.707 1.603 . . . . 0.0 111.354 177.039 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -44.91 -63.21 0.97 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.651 1.58 . . . . 0.0 110.359 174.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.404 ' NE2' HG11 ' A' ' 131' ' ' VAL . 69.7 mm-40 -54.65 -59.64 4.43 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.108 0.963 . . . . 0.0 109.241 -176.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 35.8 mt -56.91 -34.63 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 125.438 1.495 . . . . 0.0 110.395 -170.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.56 -28.38 71.26 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 117.958 -1.468 . . . . 0.0 114.065 -178.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 72.4 t -71.95 -40.71 68.43 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.183 0 CA-C-N 119.027 1.414 . . . . 0.0 108.635 177.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.89 -43.8 97.83 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.218 0.607 . . . . 0.0 109.71 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.88 -43.58 95.61 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.081 -0.387 . . . . 0.0 110.931 174.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.39 -30.21 75.0 Favored Glycine 0 C--O 1.222 -0.604 0 N-CA-C 110.633 -0.987 . . . . 0.0 110.633 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.9 tp -69.33 -24.0 63.86 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 120.49 -1.594 . . . . 0.0 112.018 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.85 -21.46 62.42 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.849 -0.596 . . . . 0.0 111.793 170.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.441 HD12 ' CE2' ' A' ' 95' ' ' TYR . 28.7 mm -135.52 92.89 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 C-N-CA 126.261 1.824 . . . . 0.0 107.539 -158.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 74.7 m 60.2 54.91 4.05 Favored Pre-proline 0 CA--C 1.553 1.063 0 O-C-N 121.348 -0.845 . . . . 0.0 112.176 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -60.03 -38.15 79.88 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.968 3.112 . . . . 0.0 111.796 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -55.71 -52.65 63.15 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.699 1.199 . . . . 0.0 109.68 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -61.43 -38.26 86.52 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.684 1.194 . . . . 0.0 111.054 177.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -52.89 58.17 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -62.38 -43.16 99.48 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.866 0.866 . . . . 0.0 111.743 -175.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -61.25 -44.0 97.96 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 119.248 0.931 . . . . 0.0 110.045 -176.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -69.64 -35.89 75.6 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 117.289 -1.339 . . . . 0.0 112.422 -176.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.9 mm -56.5 -53.67 37.94 Favored 'Isoleucine or valine' 0 C--N 1.339 0.149 0 CA-C-N 119.215 0.916 . . . . 0.0 109.469 168.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.75 -21.7 66.06 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -177.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.95 -8.13 58.87 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 126.752 2.021 . . . . 0.0 113.663 169.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 44.89 43.55 7.15 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.238 2.215 . . . . 0.0 110.531 -169.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -103.53 -2.13 27.26 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.407 2.283 . . . . 0.0 115.06 -177.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.13 135.06 44.38 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.011 1.324 . . . . 0.0 110.664 -160.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 71.7 t -120.4 117.45 53.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 124.462 1.105 . . . . 0.0 108.041 -175.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.462 ' CD2' HG23 ' A' ' 136' ' ' THR . 23.3 t80 -80.76 152.64 28.21 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.604 1.562 . . . . 0.0 108.357 163.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -173.79 165.32 37.11 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 171.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 36.1 mm -104.06 141.7 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 170.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.57 HG13 HG11 ' A' ' 61' ' ' VAL . 24.1 t -44.23 -71.66 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 127.322 2.249 . . . . 0.0 114.43 -171.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.1 mptt 55.77 165.8 0.06 OUTLIER Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 125.281 1.432 . . . . 0.0 113.777 -169.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.64 -4.39 14.52 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.11 2.54 . . . . 0.0 113.86 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.32 -70.37 0.1 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.127 2.171 . . . . 0.0 112.388 -174.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.5 171.39 13.43 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.124 0.97 . . . . 0.0 109.042 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -66.04 142.03 57.95 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 165.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.57 HG11 HG13 ' A' ' 55' ' ' VAL . 0.3 OUTLIER -152.62 158.27 33.29 Favored Pre-proline 0 C--O 1.242 0.67 0 C-N-CA 123.658 0.783 . . . . 0.0 110.176 169.223 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.88 178.79 3.7 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 124.34 3.36 . . . . 0.0 111.197 166.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -76.2 167.78 21.24 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.346 -0.846 . . . . 0.0 111.391 178.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.44 18.72 77.18 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 118.603 -1.11 . . . . 0.0 114.402 165.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.2 m -130.24 21.88 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 118.764 1.282 . . . . 0.0 112.402 -174.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.74 -17.27 3.26 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 118.43 2.752 . . . . 0.0 118.43 -162.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -149.57 18.91 0.93 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 127.237 2.215 . . . . 0.0 109.195 -174.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.442 ' CD1' ' HG3' ' A' ' 85' ' ' LYS . 3.1 m-85 -69.7 148.86 48.69 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 171.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.0 t -67.23 161.56 24.59 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 155.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -141.99 141.92 32.91 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.814 161.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.1 133.75 52.88 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 172.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.7 p -156.79 149.96 10.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 174.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.25 170.32 15.8 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.709 1.14 . . . . 0.0 109.578 173.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.66 -29.98 63.89 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 122.134 0.968 . . . . 0.0 112.239 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -90.96 -37.61 13.38 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 127.51 2.324 . . . . 0.0 111.889 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . 0.279 0.0 OUTLIER -91.59 30.37 1.34 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.346 0.975 . . . . 0.0 111.859 -169.536 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -45.57 -53.98 8.27 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.51 1.124 . . . . 0.0 112.878 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -86.75 6.34 31.91 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.817 1.247 . . . . 0.0 112.537 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -92.17 -106.42 1.59 Allowed Glycine 0 CA--C 1.525 0.707 0 C-N-CA 126.68 2.086 . . . . 0.0 110.91 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 39.9 m -90.0 153.61 20.46 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.261 1.425 . . . . 0.0 108.893 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tt -153.62 146.25 14.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 O-C-N 120.14 -1.6 . . . . 0.0 108.777 162.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mt -128.39 113.05 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 178.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -90.77 143.43 26.73 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -148.6 160.18 43.36 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.983 -1.073 . . . . 0.0 111.612 170.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.442 ' HG3' ' CD1' ' A' ' 68' ' ' TYR . 1.3 tmtt? -148.91 129.37 13.9 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.073 0.949 . . . . 0.0 108.951 171.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ALA . . . . . 0.424 ' HA ' HG22 ' A' ' 91' ' ' VAL . . . -104.82 115.27 30.02 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 124.053 0.941 . . . . 0.0 110.09 -174.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -126.41 99.24 5.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.403 2.281 . . . . 0.0 108.512 -165.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 67.21 -83.13 0.13 Allowed Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.747 1.165 . . . . 0.0 114.821 173.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -133.78 20.82 3.86 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.242 2.217 . . . . 0.0 110.752 176.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.2 146.63 45.12 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.376 1.87 . . . . 0.0 109.022 -174.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' VAL . . . . . 0.424 HG22 ' HA ' ' A' ' 86' ' ' ALA . 96.8 t -131.72 124.53 54.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 169.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.468 ' N ' HD12 ' A' ' 92' ' ' ILE . 2.8 mp -93.04 101.47 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 105.094 -2.187 . . . . 0.0 105.094 177.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.5 mt -92.67 121.13 43.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -121.13 96.05 4.94 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 126.742 2.017 . . . . 0.0 107.4 -175.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.441 ' CE2' HD12 ' A' ' 36' ' ' ILE . 34.5 p90 -113.45 168.26 9.9 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.386 -1.446 . . . . 0.0 111.421 -174.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.1 t -155.44 179.39 9.22 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.844 1.658 . . . . 0.0 107.195 177.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.2 p -122.19 2.4 9.79 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 127.056 2.143 . . . . 0.0 110.019 171.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -139.84 131.76 27.7 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-O 121.117 0.484 . . . . 0.0 111.363 164.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -3.26 3.8 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 128.486 2.715 . . . . 0.0 112.994 177.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -122.59 33.06 5.54 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.546 1.538 . . . . 0.0 110.264 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.4 p -130.43 -164.43 1.42 Allowed 'General case' 0 CA--C 1.546 0.809 0 O-C-N 120.686 -1.259 . . . . 0.0 112.695 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -100.58 154.28 18.7 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.231 1.413 . . . . 0.0 108.481 169.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -89.46 158.2 17.81 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.845 0.858 . . . . 0.0 110.354 -172.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -67.36 -178.91 0.92 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.443 1.097 . . . . 0.0 109.154 160.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -140.68 97.82 3.28 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -97.08 160.89 14.08 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 155.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -156.13 91.03 1.24 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.624 1.17 . . . . 0.0 107.857 169.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -96.34 163.45 13.07 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.611 0.764 . . . . 0.0 109.562 -178.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 40.9 p -81.46 163.01 23.05 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 166.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.37 -43.15 78.92 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 123.637 0.775 . . . . 0.0 109.007 169.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.79 -39.71 95.08 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.369 -0.824 . . . . 0.0 111.583 -176.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.8 -65.74 0.51 Allowed 'General case' 0 C--N 1.345 0.41 0 CA-C-O 118.537 -0.744 . . . . 0.0 109.321 168.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 93.9 mt -54.73 -30.74 57.03 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.221 1.009 . . . . 0.0 112.304 -174.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 59.7 tttt -66.31 -46.74 75.88 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 -7.69 58.83 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 124.609 1.163 . . . . 0.0 113.097 178.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -73.01 -66.13 0.71 Allowed 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 160.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -130.06 11.48 5.54 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 120.537 -1.352 . . . . 0.0 113.918 -154.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' TYR . . . . . 0.482 ' CZ ' ' HE2' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -140.65 22.48 2.32 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 120.796 -1.19 . . . . 0.0 111.622 179.324 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLN . . . . . 0.61 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.4 OUTLIER -73.77 -45.55 51.04 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 105.097 -2.186 . . . . 0.0 105.097 -163.19 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.8 t -91.52 150.83 21.02 Favored 'General case' 0 C--N 1.352 0.674 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -74.51 -20.34 60.01 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-O 117.327 -1.32 . . . . 0.0 112.257 177.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 4.2 t -81.24 -32.4 33.38 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 120.212 1.369 . . . . 0.0 110.932 -178.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.61 HE22 ' NE2' ' A' ' 119' ' ' GLN . 7.8 pt20 -62.29 -26.77 68.59 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.981 1.264 . . . . 0.0 111.405 -176.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.482 ' HE2' ' CZ ' ' A' ' 118' ' ' TYR . 2.6 mtpm? -47.87 -29.61 3.42 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 125.986 1.714 . . . . 0.0 113.463 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -52.67 -59.38 4.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.482 1.513 . . . . 0.0 110.26 175.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.73 -49.89 66.79 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 125.478 1.511 . . . . 0.0 110.013 -177.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 13.6 t -54.4 -54.85 18.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.405 -178.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -65.07 -25.62 67.88 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 178.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -65.41 -34.75 79.04 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.704 172.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -66.08 -34.82 78.94 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 119.963 1.256 . . . . 0.0 111.098 173.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.404 HG11 ' NE2' ' A' ' 27' ' ' GLN . 18.2 t -73.41 -12.01 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 O-C-N 121.558 -0.714 . . . . 0.0 111.136 177.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -121.34 22.14 10.88 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.491 1.517 . . . . 0.0 111.951 -176.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -132.86 -0.13 4.39 Favored Glycine 0 CA--C 1.528 0.9 0 O-C-N 120.876 -1.14 . . . . 0.0 112.684 174.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -76.26 -178.09 4.35 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 125.913 1.685 . . . . 0.0 111.632 173.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.1 mtt-85 -130.62 166.43 20.69 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 126.33 1.852 . . . . 0.0 107.013 164.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' THR . . . . . 0.462 HG23 ' CD2' ' A' ' 52' ' ' TYR . 2.3 m -122.73 -0.51 9.1 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 124.295 1.038 . . . . 0.0 111.013 177.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 C--O 1.246 0.884 0 CA-C-O 115.198 -2.334 . . . . 0.0 107.595 -149.151 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.811 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 45.0 28.36 0.36 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.988 1.715 . . . . 0.0 113.967 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 14.6 ptt? -96.26 -164.38 1.15 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.305 1.842 . . . . 0.0 110.794 -165.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -131.91 -178.94 5.11 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 161.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.5 m-30 58.41 -173.26 0.09 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.061 1.745 . . . . 0.0 109.173 -175.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 p -131.22 152.39 50.55 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.182 1.393 . . . . 0.0 107.29 168.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -59.33 -42.89 92.53 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 124.357 1.063 . . . . 0.0 109.769 -173.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -45.12 -47.64 12.12 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.019 1.728 . . . . 0.0 111.998 172.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -73.84 -28.71 61.74 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.685 1.194 . . . . 0.0 111.846 -174.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 71.4 mt -83.15 -34.12 10.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 C-N-CA 125.018 1.327 . . . . 0.0 110.11 -176.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.59 -36.78 93.7 Favored Glycine 0 C--N 1.336 0.538 0 CA-C-N 118.997 0.817 . . . . 0.0 112.157 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.7 t -56.81 -47.8 82.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 CA-C-N 117.474 0.637 . . . . 0.0 109.972 175.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 mp -60.02 -46.77 88.39 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.688 0.676 . . . . 0.0 109.27 177.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.7 -25.5 68.23 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -98.89 -24.31 10.77 Favored Glycine 0 CA--C 1.53 1.016 0 CA-C-N 119.059 0.845 . . . . 0.0 112.225 176.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mp -62.68 -28.14 69.73 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.067 1.933 . . . . 0.0 110.391 165.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.59 -24.0 61.03 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.094 1.358 . . . . 0.0 113.289 172.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.7 mm -142.38 93.12 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 C-N-CA 125.255 1.422 . . . . 0.0 107.428 -166.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.83 65.49 1.0 Allowed Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 125.783 1.633 . . . . 0.0 111.282 -176.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -60.98 -33.28 92.54 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.3 2.667 . . . . 0.0 111.643 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -71.25 -40.86 70.75 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.582 0.753 . . . . 0.0 109.343 -176.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.401 ' HA ' ' HG2' ' A' ' 43' ' ' GLN . 44.7 t90 -64.54 -37.52 87.84 Favored 'General case' 0 CA--C 1.53 0.19 0 O-C-N 121.985 -0.447 . . . . 0.0 111.22 173.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.0 tt -59.78 -49.86 76.06 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 120.998 -1.064 . . . . 0.0 108.682 173.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 85.2 mttt -59.62 -48.04 83.22 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 116.879 -1.534 . . . . 0.0 113.161 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.401 ' HG2' ' HA ' ' A' ' 40' ' ' TRP . 0.0 OUTLIER -57.63 -38.95 75.86 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 120.167 1.349 . . . . 0.0 111.157 -176.052 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -75.64 -48.5 21.87 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.65 1.18 . . . . 0.0 110.732 -176.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.3 mm -59.62 -32.03 48.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 119.419 1.009 . . . . 0.0 111.151 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.7 -39.04 70.48 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.458 1.026 . . . . 0.0 111.329 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -110.11 19.81 18.56 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.851 1.26 . . . . 0.0 111.758 176.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 58.78 14.54 3.27 Favored 'General case' 0 CA--C 1.549 0.905 0 O-C-N 120.247 -1.533 . . . . 0.0 113.808 177.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -69.94 -6.61 34.22 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.529 1.932 . . . . 0.0 113.422 -171.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.3 tp -86.01 131.01 34.37 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 125.086 1.354 . . . . 0.0 108.275 -172.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 98.8 t -106.44 131.07 57.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 171.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -94.09 116.36 28.77 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 161.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -144.3 164.06 27.7 Favored Glycine 0 CA--C 1.522 0.501 0 N-CA-C 111.778 -0.529 . . . . 0.0 111.778 171.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 22.8 mm -101.62 140.99 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -177.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.549 HG13 HG11 ' A' ' 61' ' ' VAL . 31.1 t -51.7 -73.42 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 C-N-CA 125.876 1.67 . . . . 0.0 110.927 175.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? 56.62 166.01 0.06 OUTLIER Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 125.728 1.611 . . . . 0.0 112.84 -168.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -70.34 75.85 1.42 Allowed 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 121.746 1.631 . . . . 0.0 109.061 160.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.1 t -130.51 -56.02 1.08 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 125.053 1.341 . . . . 0.0 110.986 -167.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -130.46 176.14 8.39 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.194 0.998 . . . . 0.0 108.625 -171.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 63.5 m -57.92 113.95 2.11 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.594 0.758 . . . . 0.0 109.814 171.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.549 HG11 HG13 ' A' ' 55' ' ' VAL . 6.1 m -137.98 159.34 68.89 Favored Pre-proline 0 C--O 1.239 0.521 0 O-C-N 121.965 -0.459 . . . . 0.0 110.236 174.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -72.26 175.64 9.68 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 123.578 2.852 . . . . 0.0 111.475 169.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -71.26 152.19 43.53 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 123.867 0.867 . . . . 0.0 111.34 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.65 28.93 33.87 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.856 -0.969 . . . . 0.0 114.483 162.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.0 m -140.52 28.68 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 124.405 1.082 . . . . 0.0 111.203 -174.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -64.0 -16.16 60.99 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 -153.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -151.51 29.14 0.62 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 127.609 2.363 . . . . 0.0 108.496 173.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -71.46 148.31 46.97 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 172.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.432 ' HB2' ' CE1' ' A' ' 84' ' ' PHE . 0.0 OUTLIER -77.97 142.49 38.29 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.463 -1.68 . . . . 0.0 106.463 166.01 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 31.4 p90 -128.06 135.31 49.66 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 123.874 0.87 . . . . 0.0 109.412 170.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.23 131.39 46.2 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 172.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.422 ' HB ' HG13 ' A' ' 81' ' ' ILE . 7.5 p -151.39 166.66 1.95 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 172.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.4 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -95.01 156.26 16.39 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 165.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.41 -16.14 53.21 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -113.21 -2.01 14.2 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.77 1.228 . . . . 0.0 111.978 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.4 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 31.6 m-20 -110.43 22.77 15.09 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.373 1.069 . . . . 0.0 110.08 -170.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -44.88 -63.95 0.81 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.267 1.027 . . . . 0.0 111.154 -174.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -82.75 -16.65 47.16 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.796 0.438 . . . . 0.0 110.196 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -54.76 -80.22 0.08 OUTLIER Glycine 0 CA--C 1.527 0.81 0 C-N-CA 127.994 2.711 . . . . 0.0 113.82 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 m -148.45 148.78 30.66 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.208 1.004 . . . . 0.0 108.683 -176.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.422 HG13 ' HB ' ' A' ' 72' ' ' VAL . 3.7 tt -150.67 148.49 15.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-N 119.175 0.898 . . . . 0.0 109.225 -177.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 50.1 mt -134.85 110.01 12.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 N-CA-C 107.823 -1.176 . . . . 0.0 107.823 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 66.2 m-85 -85.83 146.62 26.67 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 169.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.432 ' CE1' ' HB2' ' A' ' 69' ' ' SER . 26.3 p90 -149.59 164.47 35.03 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.626 -1.296 . . . . 0.0 110.152 167.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.65 124.31 4.94 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 167.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.84 124.89 28.68 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 161.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -123.21 115.51 21.87 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 166.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 70.24 -96.77 0.56 Allowed Glycine 0 CA--C 1.523 0.575 0 C-N-CA 124.102 0.858 . . . . 0.0 112.817 175.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 80.8 mm-40 -136.29 21.31 3.19 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.572 1.949 . . . . 0.0 110.364 -177.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.0 m -125.97 149.28 48.9 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.63 1.572 . . . . 0.0 107.368 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 60.0 t -122.41 130.54 74.44 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.376 0 N-CA-C 106.541 -1.652 . . . . 0.0 106.541 166.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.444 ' N ' HD12 ' A' ' 92' ' ' ILE . 1.1 mp -106.66 92.82 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.79 0 N-CA-C 105.215 -2.143 . . . . 0.0 105.215 176.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.6 mt -77.87 129.91 36.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -131.06 98.12 4.49 Favored 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 125.535 1.534 . . . . 0.0 107.089 -174.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -124.15 164.65 19.04 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.613 -1.305 . . . . 0.0 110.461 -168.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.1 t -156.49 160.51 39.61 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.121 0.568 . . . . 0.0 109.64 174.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.9 p -108.7 8.2 26.78 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.17 1.788 . . . . 0.0 110.987 171.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -152.63 101.97 2.68 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 127.148 2.179 . . . . 0.0 106.711 -178.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 tpt180 -44.26 -50.61 8.84 Favored 'General case' 0 C--N 1.311 -1.081 0 C-N-CA 130.92 3.688 . . . . 0.0 110.594 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.512 HD22 HG23 ' A' ' 101' ' ' THR . 0.3 OUTLIER -75.35 3.5 8.94 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -176.492 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.512 HG23 HD22 ' A' ' 100' ' ' ASN . 21.0 p -119.85 165.52 14.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.849 0.356 . . . . 0.0 110.903 171.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' A' ' 103' ' ' LEU . 10.5 ptmt -65.49 173.28 2.77 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 122.669 1.223 . . . . 0.0 111.379 -177.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.412 ' O ' ' HE2' ' A' ' 102' ' ' LYS . 2.9 mm? -82.3 153.49 25.8 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 114.732 -1.122 . . . . 0.0 109.84 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -69.68 -179.7 1.86 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.855 0.862 . . . . 0.0 109.024 156.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -138.61 120.0 14.86 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.559 1.144 . . . . 0.0 108.211 169.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 mttm -112.08 106.27 14.86 Favored 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 105.498 -2.038 . . . . 0.0 105.498 158.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -84.06 135.48 34.4 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 160.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -134.48 158.17 44.62 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.774 1.63 . . . . 0.0 106.763 169.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.9 p -69.42 155.13 40.95 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.195 -1.002 . . . . 0.0 109.634 161.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.0 mt -58.4 -30.54 66.92 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.703 -0.623 . . . . 0.0 111.313 169.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 5.0 t -64.76 -44.05 91.33 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 117.323 -1.322 . . . . 0.0 111.447 173.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.84 -57.08 10.37 Favored 'General case' 0 C--N 1.344 0.338 0 CA-C-N 120.053 1.297 . . . . 0.0 109.561 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 16.0 mt -58.49 -44.85 89.54 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 125.314 1.445 . . . . 0.0 111.156 -179.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 72.2 tttt -61.22 -38.69 87.51 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.529 -0.732 . . . . 0.0 110.944 177.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -81.74 -19.25 41.79 Favored 'General case' 0 C--O 1.223 -0.329 0 O-C-N 120.463 -1.398 . . . . 0.0 111.127 -175.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -79.03 -50.64 10.76 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.544 1.138 . . . . 0.0 111.328 171.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -123.03 18.1 10.04 Favored 'General case' 0 N--CA 1.466 0.339 0 O-C-N 121.16 -0.962 . . . . 0.0 112.608 -165.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.463 ' CZ ' ' HE2' ' A' ' 124' ' ' LYS . 2.9 t80 -148.39 30.99 0.83 Allowed 'General case' 0 CA--C 1.533 0.307 0 O-C-N 120.535 -1.353 . . . . 0.0 110.066 175.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.531 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.4 OUTLIER -63.97 -65.2 0.71 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 -176.065 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.5 p -75.89 175.77 8.46 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.617 0.767 . . . . 0.0 111.285 -169.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.74 -42.38 11.98 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 121.116 -0.99 . . . . 0.0 110.235 173.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.2 m -57.77 -39.84 78.4 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-N 118.923 0.783 . . . . 0.0 111.374 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.531 HE22 ' NE2' ' A' ' 119' ' ' GLN . 7.8 tt0 -58.65 -25.54 62.87 Favored 'General case' 0 N--CA 1.463 0.194 0 C-N-CA 124.225 1.01 . . . . 0.0 111.976 -178.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.463 ' HE2' ' CZ ' ' A' ' 118' ' ' TYR . 7.7 mtpt -63.47 -21.26 66.21 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.532 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -65.35 -64.3 0.89 Allowed 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 167.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.43 -48.74 76.38 Favored 'General case' 0 C--O 1.222 -0.371 0 C-N-CA 123.405 0.682 . . . . 0.0 112.254 -168.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 97.7 t -56.12 -54.04 31.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -66.13 -18.25 65.23 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.202 0.815 . . . . 0.0 113.202 178.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -75.25 -44.08 48.01 Favored 'General case' 0 CA--C 1.52 -0.175 0 C-N-CA 125.461 1.504 . . . . 0.0 109.735 175.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -59.67 -32.02 70.1 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.848 0.859 . . . . 0.0 110.07 171.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 38.8 t -69.96 -20.53 23.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 O-C-N 120.654 -1.279 . . . . 0.0 111.977 172.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -118.39 20.98 12.88 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 124.92 1.288 . . . . 0.0 111.438 -173.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -134.75 18.41 4.08 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 127.315 2.388 . . . . 0.0 110.857 169.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -90.55 164.95 14.03 Favored 'General case' 0 C--O 1.238 0.491 0 C-N-CA 123.976 0.911 . . . . 0.0 110.151 169.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.47 165.36 11.08 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 125.719 1.608 . . . . 0.0 107.157 162.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -136.15 -4.96 2.12 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 124.519 1.127 . . . . 0.0 111.776 -167.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 . . . . . 0 C--O 1.247 0.931 0 C-N-CA 131.246 3.818 . . . . 0.0 102.638 -172.585 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.458 0 N-CA-C 112.005 -0.438 . . . . 0.0 112.005 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 44.74 56.43 5.22 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 127.459 2.304 . . . . 0.0 112.608 171.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -149.22 146.4 27.59 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 177.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.12 168.61 0.14 Allowed 'General case' 0 C--O 1.238 0.49 0 C-N-CA 125.136 1.374 . . . . 0.0 109.6 -158.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -77.53 170.79 15.96 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -178.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 p -121.09 162.62 19.72 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 161.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -62.7 -35.13 78.72 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.561 0.696 . . . . 0.0 110.3 -165.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -43.3 95.27 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 124.486 1.115 . . . . 0.0 110.59 177.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 22.0 mm-40 -58.68 -47.52 84.22 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.836 0.854 . . . . 0.0 108.748 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 88.0 mt -65.07 -41.9 93.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 C-N-CA 123.722 0.809 . . . . 0.0 109.371 178.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.65 -43.75 91.31 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 123.657 0.646 . . . . 0.0 112.667 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 25.9 t -60.76 -51.62 71.07 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 C-N-CA 123.493 0.717 . . . . 0.0 109.34 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.4 mt -63.3 -33.39 75.4 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 119.532 1.06 . . . . 0.0 111.76 -175.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.1 95.23 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 122.835 0.454 . . . . 0.0 110.033 173.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.84 7.09 44.4 Favored Glycine 0 CA--C 1.536 1.374 0 CA-C-O 118.445 -1.197 . . . . 0.0 113.091 173.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.4 mt -100.8 -8.9 22.23 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 119.788 1.794 . . . . 0.0 111.753 162.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -98.99 -10.03 23.21 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.157 0.983 . . . . 0.0 113.414 173.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.479 HD12 ' CE2' ' A' ' 95' ' ' TYR . 40.5 mm -139.73 93.61 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 C-N-CA 129.684 3.194 . . . . 0.0 107.484 -172.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 63.01 73.42 0.51 Allowed Pre-proline 0 CA--C 1.552 1.041 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 176.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -78.86 -30.31 2.94 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.439 2.093 . . . . 0.0 111.588 -171.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -64.51 -44.22 91.6 Favored 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 125.391 1.476 . . . . 0.0 109.743 -176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.409 ' CZ3' HD12 ' A' ' 82' ' ' ILE . 63.9 t90 -52.37 -62.54 1.58 Allowed 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 125.172 1.389 . . . . 0.0 110.093 168.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.0 tt -52.16 -51.94 54.9 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 118.704 0.684 . . . . 0.0 111.471 -175.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.1 mttm -59.25 -44.92 92.36 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.343 -0.837 . . . . 0.0 111.413 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -60.98 -45.48 94.61 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 119.633 1.106 . . . . 0.0 110.631 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -58.26 -42.88 87.4 Favored 'General case' 0 N--CA 1.455 -0.188 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 29.6 mm -64.78 -46.11 93.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-N 118.741 0.7 . . . . 0.0 110.178 176.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.36 -20.27 53.41 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.618 1.099 . . . . 0.0 112.311 176.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -102.16 1.14 35.73 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.623 1.569 . . . . 0.0 112.623 174.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 44.95 33.96 1.14 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.497 2.319 . . . . 0.0 111.14 -170.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -88.97 -18.08 28.16 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.802 2.041 . . . . 0.0 112.976 -173.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.88 130.5 37.67 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.484 1.514 . . . . 0.0 109.458 -163.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 55.6 t -108.52 156.9 8.94 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-O 122.955 1.359 . . . . 0.0 108.215 172.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -126.96 138.37 53.26 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 127.516 2.326 . . . . 0.0 105.249 176.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -161.62 -178.84 35.89 Favored Glycine 0 N--CA 1.445 -0.724 0 CA-C-O 122.241 0.912 . . . . 0.0 112.428 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.4 mm -124.48 134.85 65.63 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.817 0 C-N-CA 129.161 2.984 . . . . 0.0 104.73 -173.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.487 HG13 HG21 ' A' ' 61' ' ' VAL . 21.3 t -44.73 -53.96 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 C-N-CA 124.104 0.962 . . . . 0.0 113.287 -176.299 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.9 mmtt 65.16 156.31 0.12 Allowed Pre-proline 0 CA--C 1.532 0.257 0 C-N-CA 129.213 3.005 . . . . 0.0 111.09 -171.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -65.96 -3.11 7.74 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 124.103 3.202 . . . . 0.0 113.897 -176.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 m -120.02 -2.41 10.25 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 120.796 -1.19 . . . . 0.0 113.904 -162.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -89.58 173.01 8.55 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 120.814 1.643 . . . . 0.0 113.471 -170.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.6 t -76.33 35.75 0.15 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 129.51 3.124 . . . . 0.0 112.682 179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.487 HG21 HG13 ' A' ' 55' ' ' VAL . 2.5 m -90.33 151.87 45.0 Favored Pre-proline 0 CA--C 1.536 0.441 0 O-C-N 120.675 -1.266 . . . . 0.0 113.502 -163.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -71.0 158.11 56.21 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 123.398 2.732 . . . . 0.0 110.278 176.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.93 144.27 56.33 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 123.393 0.677 . . . . 0.0 109.479 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.85 20.89 45.04 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-N 119.164 0.893 . . . . 0.0 113.429 176.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 6.4 m -140.29 90.81 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 104.308 -2.479 . . . . 0.0 104.308 166.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -92.42 -15.89 26.61 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 112.859 0.688 . . . . 0.0 112.859 174.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -169.7 46.37 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 125.999 1.72 . . . . 0.0 110.956 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.401 ' O ' HG23 ' A' ' 55' ' ' VAL . 4.9 m-85 -94.9 114.96 26.87 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 105.734 -1.95 . . . . 0.0 105.734 162.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.83 154.41 7.18 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.439 1.018 . . . . 0.0 110.424 173.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 38.7 p90 -130.78 153.74 48.74 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.326 0.651 . . . . 0.0 110.447 -179.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -119.1 134.45 55.19 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 126.767 2.027 . . . . 0.0 106.573 170.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.6 p -147.89 158.42 8.38 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 N-CA-C 104.722 -2.325 . . . . 0.0 104.722 171.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -85.75 164.6 17.5 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-N 119.931 1.241 . . . . 0.0 107.905 168.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.63 0.4 26.6 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 121.354 -0.841 . . . . 0.0 112.807 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -137.87 4.03 2.51 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 119.492 1.042 . . . . 0.0 112.678 -168.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -128.31 34.0 4.62 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.483 1.913 . . . . 0.0 109.569 -177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -56.79 -13.38 2.51 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -163.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -125.42 7.06 7.67 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 121.064 1.756 . . . . 0.0 111.893 174.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -82.38 -71.28 1.31 Allowed Glycine 0 N--CA 1.446 -0.683 0 C-N-CA 126.494 1.997 . . . . 0.0 110.065 -178.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 10.8 m -118.79 171.13 8.43 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 117.981 0.891 . . . . 0.0 109.462 -179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.0 tt -168.32 148.52 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.521 0 C-N-CA 126.958 2.103 . . . . 0.0 106.945 158.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.409 HD12 ' CZ3' ' A' ' 40' ' ' TRP . 73.5 mt -132.58 131.2 60.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.106 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 173.137 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -105.52 151.5 24.22 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 125.583 1.553 . . . . 0.0 108.69 172.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -144.08 156.93 44.56 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 124.678 1.191 . . . . 0.0 108.783 170.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.401 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 18.0 tttt -144.91 134.53 23.36 Favored 'General case' 0 CA--C 1.512 -0.505 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 161.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -70.41 123.22 21.24 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 159.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -99.09 23.16 9.38 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.013 0.925 . . . . 0.0 109.037 165.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 76.8 115.08 0.14 Allowed Glycine 0 C--N 1.34 0.772 0 C-N-CA 125.963 1.744 . . . . 0.0 110.821 175.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 61.54 0.77 0.5 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.718 1.607 . . . . 0.0 113.645 -173.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -143.41 149.78 38.13 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 127.556 2.342 . . . . 0.0 106.628 177.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 57.5 t -126.78 129.57 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.414 0 N-CA-C 106.084 -1.821 . . . . 0.0 106.084 172.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 19.4 mm -100.09 112.96 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 174.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.5 mt -101.43 118.07 47.64 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.467 ' HB3' HD13 ' A' ' 103' ' ' LEU . 72.9 mttt -116.72 104.99 11.91 Favored 'General case' 0 C--O 1.223 -0.306 0 C-N-CA 126.936 2.094 . . . . 0.0 107.17 -172.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.479 ' CE2' HD12 ' A' ' 36' ' ' ILE . 40.1 p90 -125.79 169.71 12.33 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.164 -1.585 . . . . 0.0 110.761 -177.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.1 t -151.26 168.7 23.94 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 125.149 1.38 . . . . 0.0 108.317 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.9 p -88.65 -12.73 41.62 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.664 1.185 . . . . 0.0 113.178 167.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -150.1 137.36 19.64 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 123.55 0.74 . . . . 0.0 109.771 -174.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 29.6 ttt180 -60.14 -21.03 61.11 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.577 1.551 . . . . 0.0 112.04 -177.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -94.47 2.4 55.73 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 71.6 p -121.88 156.35 33.5 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 119.352 0.978 . . . . 0.0 112.771 -172.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 3.2 tmtt? -64.4 135.62 56.3 Favored 'General case' 0 C--N 1.342 0.268 0 C-N-CA 124.63 1.172 . . . . 0.0 109.819 -169.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.467 HD13 ' HB3' ' A' ' 94' ' ' LYS . 83.4 mt -72.81 143.9 47.71 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 123.984 0.914 . . . . 0.0 109.763 -176.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -71.24 -171.69 0.62 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.226 1.41 . . . . 0.0 109.439 171.04 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.93 103.91 4.09 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.114 -0.991 . . . . 0.0 110.172 170.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -85.3 147.53 26.5 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 106.147 -1.797 . . . . 0.0 106.147 147.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -137.5 127.31 25.53 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 168.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.4 mt -141.67 139.26 32.94 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -168.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 16.9 p -69.28 154.64 41.71 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.319 0.963 . . . . 0.0 109.873 173.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 20.4 mt -59.45 -28.54 67.08 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.314 -0.866 . . . . 0.0 110.046 168.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.46 -29.94 65.44 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.81 -0.556 . . . . 0.0 112.329 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -70.11 -59.84 2.66 Favored 'General case' 0 N--CA 1.433 -1.296 0 N-CA-C 105.856 -1.905 . . . . 0.0 105.856 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 11.5 mt -57.61 -37.08 72.67 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.76 1.224 . . . . 0.0 113.138 -175.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -70.57 -31.75 68.89 Favored 'General case' 0 C--N 1.341 0.2 0 O-C-N 121.49 -0.756 . . . . 0.0 110.21 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.401 ' HE2' ' HA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -67.78 -63.02 1.14 Allowed 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 106.913 -1.514 . . . . 0.0 106.913 174.743 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -46.88 -53.55 11.89 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.315 1.446 . . . . 0.0 111.59 -173.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -119.14 11.46 12.38 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 121.827 -0.546 . . . . 0.0 111.953 -163.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -149.44 34.85 0.71 Allowed 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -179.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.65 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -81.08 -40.33 24.29 Favored 'General case' 0 C--N 1.342 0.278 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -176.334 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 16.6 p -89.02 -178.84 5.79 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 120.899 1.681 . . . . 0.0 110.543 -176.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 2.3 ttm180 -88.45 -45.41 9.98 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 120.994 -1.066 . . . . 0.0 109.314 170.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 37.3 p -66.63 -30.27 70.51 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 119.301 0.955 . . . . 0.0 111.213 -175.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.65 HE22 ' NE2' ' A' ' 119' ' ' GLN . 12.0 tt0 -58.43 -30.96 67.31 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.256 0.934 . . . . 0.0 110.618 176.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.2 mtpm? -59.76 -27.22 66.34 Favored 'General case' 0 C--N 1.339 0.132 0 O-C-N 121.612 -0.68 . . . . 0.0 111.78 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -67.18 -50.23 61.76 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.045 1.338 . . . . 0.0 108.853 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -63.85 -48.68 75.78 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 121.679 0.752 . . . . 0.0 111.815 176.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 54.8 t -53.98 -54.48 20.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.382 -177.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -63.79 -24.99 67.98 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 177.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -64.08 -43.66 94.73 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 118.852 0.751 . . . . 0.0 110.244 171.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -60.05 -37.07 78.75 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.619 1.099 . . . . 0.0 110.418 175.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 22.0 t -71.05 -8.85 11.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.781 0 C-N-CA 123.626 0.77 . . . . 0.0 111.61 178.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -117.57 -14.53 10.26 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.741 1.216 . . . . 0.0 113.376 178.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -97.86 -5.37 57.54 Favored Glycine 0 CA--C 1.528 0.895 0 C-N-CA 125.793 1.663 . . . . 0.0 112.716 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -68.32 170.95 7.89 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 122.205 1.002 . . . . 0.0 110.352 165.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 21.4 mtp180 -127.49 174.43 9.03 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 126.927 2.091 . . . . 0.0 107.357 172.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 2.9 m -149.0 16.97 0.96 Allowed 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 119.674 1.125 . . . . 0.0 112.722 -171.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 C--O 1.252 1.222 0 C-N-CA 125.732 1.613 . . . . 0.0 108.918 -171.243 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.838 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 42.9 t-80 44.45 96.04 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 128.581 2.752 . . . . 0.0 116.031 174.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -153.99 177.64 10.83 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 123.594 0.758 . . . . 0.0 111.325 171.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.7 tptt -134.24 93.6 3.1 Favored 'General case' 0 C--N 1.341 0.218 0 C-N-CA 126.387 1.875 . . . . 0.0 106.353 173.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 12.0 m-30 52.68 -168.76 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.565 1.546 . . . . 0.0 111.3 -168.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -138.66 150.73 46.53 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 129.313 3.045 . . . . 0.0 107.972 177.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -51.07 -40.95 59.53 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.978 0.911 . . . . 0.0 110.188 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -53.19 -59.47 4.52 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 125.459 1.503 . . . . 0.0 112.52 174.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 74.2 mm-40 -63.46 -26.16 68.6 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.608 1.563 . . . . 0.0 111.407 -175.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 93.1 mt -78.55 -40.62 24.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 C-N-CA 125.184 1.394 . . . . 0.0 109.742 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.7 -40.66 89.03 Favored Glycine 0 C--N 1.334 0.464 0 C-N-CA 124.679 1.133 . . . . 0.0 112.431 -175.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.8 t -66.29 -49.37 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.3 mp -54.05 -49.6 68.64 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.202 0.91 . . . . 0.0 110.68 177.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.6 -38.01 86.04 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 123.1 0.56 . . . . 0.0 111.248 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.88 -32.58 73.82 Favored Glycine 0 CA--C 1.523 0.548 0 N-CA-C 111.81 -0.516 . . . . 0.0 111.81 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 89.0 mt -64.94 -23.32 67.19 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 120.468 -1.607 . . . . 0.0 111.671 176.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.457 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -79.98 -17.59 52.51 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.358 -0.839 . . . . 0.0 112.96 171.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.529 HD11 ' HE2' ' A' ' 106' ' ' LYS . 2.9 mp -134.52 97.73 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 125.797 1.639 . . . . 0.0 107.428 -172.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 64.92 54.96 1.25 Allowed Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.02 0.928 . . . . 0.0 110.605 175.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -56.05 -39.57 90.39 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 123.262 2.641 . . . . 0.0 111.246 -178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -67.34 -34.4 77.26 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.803 1.241 . . . . 0.0 112.527 -175.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 34.9 t90 -63.68 -54.33 37.22 Favored 'General case' 0 N--CA 1.455 -0.177 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 173.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 tt -50.96 -48.4 61.01 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.158 0.583 . . . . 0.0 110.748 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -59.32 -47.42 85.48 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.904 0.882 . . . . 0.0 111.306 175.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -58.58 -40.21 82.51 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 120.779 1.627 . . . . 0.0 112.346 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -67.01 -45.02 78.85 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.991 0.9 . . . . 0.0 109.205 -177.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.592 HD11 HD22 ' A' ' 50' ' ' LEU . 96.1 mt -71.8 -32.32 44.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 O-C-N 121.422 -0.799 . . . . 0.0 109.52 -178.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -73.83 -4.17 33.18 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.88 0.872 . . . . 0.0 112.581 173.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -92.0 -16.24 26.79 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.134 0.879 . . . . 0.0 111.673 160.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 68.83 30.26 4.81 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 127.829 2.452 . . . . 0.0 109.287 -170.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -94.96 -89.15 0.24 Allowed 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 119.023 -0.513 . . . . 0.0 109.66 178.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.723 HD23 ' HB3' ' A' ' 134' ' ' LEU 0.314 13.0 tp 40.9 97.28 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 129.592 3.157 . . . . 0.0 113.921 175.41 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.9 t -96.14 143.51 12.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.587 0 CA-C-N 120.096 1.316 . . . . 0.0 109.003 -177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -119.65 137.35 53.94 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 128.139 2.576 . . . . 0.0 107.831 174.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.15 174.77 32.56 Favored Glycine 0 N--CA 1.446 -0.689 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 176.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 6.6 mm -116.99 146.2 21.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 172.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 30.5 t -49.91 -77.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 C-N-CA 126.299 1.84 . . . . 0.0 110.755 176.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.6 mttt 57.47 165.81 0.07 OUTLIER Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 125.833 1.653 . . . . 0.0 111.77 -165.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -75.46 -32.85 4.57 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 CA-C-N 120.332 1.154 . . . . 0.0 112.777 -176.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 47.2 t -80.11 67.55 5.96 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.061 1.345 . . . . 0.0 109.043 -177.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.4 t0 -157.2 -167.19 2.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.033 1.733 . . . . 0.0 107.29 159.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 21.2 m -109.85 105.13 14.21 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 120.238 1.381 . . . . 0.0 107.622 174.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -138.08 159.21 69.25 Favored Pre-proline 0 C--O 1.237 0.446 0 CA-C-N 118.995 0.816 . . . . 0.0 112.709 -171.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -72.86 164.38 35.73 Favored 'Trans proline' 0 N--CA 1.452 -0.954 0 C-N-CA 123.467 2.778 . . . . 0.0 111.263 173.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.52 137.68 58.31 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.129 -0.941 . . . . 0.0 111.581 169.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.2 31.42 11.9 Favored Glycine 0 CA--C 1.526 0.725 0 CA-C-O 119.392 -0.671 . . . . 0.0 113.725 164.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 13.9 m -135.74 22.72 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-N 118.549 1.175 . . . . 0.0 109.988 171.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -63.27 -9.59 12.26 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 116.928 2.196 . . . . 0.0 116.928 -150.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.6 t0 -147.52 26.61 1.04 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 128.703 2.801 . . . . 0.0 111.324 172.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -78.49 153.93 30.95 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 124.064 0.946 . . . . 0.0 109.254 176.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.2 m -76.17 151.73 36.85 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 124.499 1.12 . . . . 0.0 108.684 163.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 41.7 p90 -133.85 145.56 49.8 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 124.129 0.972 . . . . 0.0 110.375 167.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 18.6 mt -115.75 137.77 51.76 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 126.406 1.883 . . . . 0.0 106.213 175.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 p -149.66 167.8 2.75 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 104.425 -2.435 . . . . 0.0 104.425 -179.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -109.75 153.59 24.12 Favored 'General case' 0 C--N 1.33 -0.273 0 O-C-N 120.213 -1.555 . . . . 0.0 108.326 167.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -76.52 3.02 12.22 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -100.33 -47.85 4.78 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 118.866 0.757 . . . . 0.0 109.977 159.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.4 m-20 -76.58 24.91 0.14 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.138 1.775 . . . . 0.0 112.453 -174.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -56.09 -28.87 59.44 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.555 1.542 . . . . 0.0 113.683 -164.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -128.0 11.71 6.59 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 127.139 2.176 . . . . 0.0 111.174 174.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -88.18 -56.92 1.97 Allowed Glycine 0 CA--C 1.53 0.98 0 C-N-CA 125.369 1.461 . . . . 0.0 111.105 176.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 75.0 m -127.97 161.4 29.22 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 125.102 1.361 . . . . 0.0 108.016 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.8 tt -156.98 154.85 5.63 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 O-C-N 120.382 -1.449 . . . . 0.0 107.671 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 64.5 mt -135.02 150.42 29.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 169.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 48.1 m-85 -124.24 158.86 31.49 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 126.977 2.111 . . . . 0.0 108.917 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -162.72 162.74 26.93 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 123.974 0.909 . . . . 0.0 110.1 171.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.5 131.09 10.63 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 170.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.78 150.38 24.61 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 123.957 0.785 . . . . 0.0 109.554 171.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -117.04 -3.45 11.57 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.256 1.822 . . . . 0.0 111.253 174.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 135.96 -37.19 1.93 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 124.879 1.228 . . . . 0.0 112.258 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.418 ' O ' ' HG ' ' A' ' 110' ' ' LEU . 0.5 OUTLIER -131.13 -59.54 0.98 Allowed 'General case' 0 C--O 1.22 -0.497 0 C-N-CA 125.951 1.7 . . . . 0.0 107.14 166.79 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.4 m -73.16 143.07 47.39 Favored 'General case' 0 C--N 1.306 -1.294 0 O-C-N 119.604 -1.935 . . . . 0.0 110.559 -175.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 71.3 t -133.35 116.06 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 -175.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.8 mp -84.36 94.71 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.856 0 N-CA-C 105.777 -1.934 . . . . 0.0 105.777 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.467 HG21 HD13 ' A' ' 36' ' ' ILE . 4.4 mt -71.24 127.94 33.8 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 N-CA-C 105.349 -2.093 . . . . 0.0 105.349 171.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.9 mttt -129.01 108.34 10.32 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 22.5 p90 -129.37 168.47 16.23 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 121.133 -0.979 . . . . 0.0 109.938 -171.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.5 t -154.63 169.62 23.44 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 124.524 1.129 . . . . 0.0 108.778 -176.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.6 p -99.32 -14.02 19.39 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.661 0.784 . . . . 0.0 111.86 162.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -134.71 126.93 30.02 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.337 1.055 . . . . 0.0 111.556 -176.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 57.4 ttt-85 -56.59 -30.33 63.07 Favored 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 126.681 1.992 . . . . 0.0 112.579 -173.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.92 50.28 1.09 Allowed 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 124.767 1.227 . . . . 0.0 109.889 -179.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 70.1 p -135.74 156.69 48.43 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.245 1.018 . . . . 0.0 108.511 164.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.33 149.17 46.38 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.247 -0.908 . . . . 0.0 111.15 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -83.89 154.54 23.37 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.983 1.313 . . . . 0.0 110.97 -175.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -71.44 171.29 11.55 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 125.876 1.671 . . . . 0.0 111.112 171.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -114.92 117.26 30.15 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.479 1.512 . . . . 0.0 108.565 167.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.529 ' HE2' HD11 ' A' ' 36' ' ' ILE . 0.0 OUTLIER -134.61 115.62 14.06 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 104.114 -2.55 . . . . 0.0 104.114 156.033 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -121.09 122.39 39.94 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 105.191 -2.152 . . . . 0.0 105.191 -172.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.403 HD11 ' HD2' ' A' ' 106' ' ' LYS . 35.6 mt -138.46 145.55 41.0 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.567 1.147 . . . . 0.0 108.674 -168.276 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 20.7 p -77.18 151.63 35.18 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 118.313 0.506 . . . . 0.0 110.73 175.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 89' ' ' GLN . 12.3 mt -51.0 -42.08 60.11 Favored 'General case' 0 N--CA 1.462 0.15 0 CA-C-O 122.237 1.017 . . . . 0.0 110.807 175.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.34 -35.89 70.49 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 125.091 1.357 . . . . 0.0 111.547 -176.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -68.03 0.37 Allowed 'General case' 0 N--CA 1.442 -0.843 0 C-N-CA 126.575 1.95 . . . . 0.0 109.652 174.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -56.61 -38.02 71.48 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.657 1.183 . . . . 0.0 111.279 -173.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -60.32 -34.14 73.38 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 122.956 0.502 . . . . 0.0 112.155 176.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . 0.4 ' HD3' ' HA ' ' A' ' 115' ' ' LYS . 0.0 OUTLIER -69.27 -58.94 3.38 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 120.787 -1.195 . . . . 0.0 108.069 173.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -45.87 -57.25 4.49 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 126.97 2.108 . . . . 0.0 110.537 -175.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -120.49 12.81 11.66 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 125.041 1.336 . . . . 0.0 112.298 -163.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.4 t80 -147.84 28.44 0.94 Allowed 'General case' 0 C--N 1.342 0.268 0 CA-C-N 120.08 1.309 . . . . 0.0 114.19 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.62 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -68.82 -60.14 2.59 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 120.758 -1.214 . . . . 0.0 111.915 179.543 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 11.0 t -99.6 163.63 12.42 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 125.362 1.465 . . . . 0.0 109.88 -164.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 53.2 mtt-85 -80.2 -38.29 31.48 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -167.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 8.1 t -57.45 -38.63 74.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.708 0.686 . . . . 0.0 109.654 174.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.62 HE22 ' NE2' ' A' ' 119' ' ' GLN . 13.0 tt0 -62.94 -25.31 68.28 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.684 -0.635 . . . . 0.0 112.368 176.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -71.66 -12.86 61.55 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 117.511 -1.233 . . . . 0.0 111.885 178.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -71.19 -73.07 0.19 Allowed 'General case' 0 CA--C 1.508 -0.667 0 CA-C-O 115.993 -1.956 . . . . 0.0 106.353 162.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 16.1 mp0 -47.71 -55.14 10.16 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-N 120.243 1.383 . . . . 0.0 112.437 -166.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 78.3 t -54.45 -50.14 60.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 C-N-CA 123.59 0.756 . . . . 0.0 110.391 -175.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.71 -34.03 73.33 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 176.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -64.14 -31.62 72.88 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 125.816 1.646 . . . . 0.0 108.835 179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.436 ' HA ' HD13 ' A' ' 45' ' ' ILE . 22.0 m-30 -68.39 -41.42 80.56 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.348 1.459 . . . . 0.0 110.957 171.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 22.7 t -65.67 -35.14 74.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-N 119.296 0.953 . . . . 0.0 109.288 172.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -80.56 10.09 5.22 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.913 -1.117 . . . . 0.0 112.712 172.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -129.72 -5.15 4.56 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 125.954 1.74 . . . . 0.0 112.181 -172.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.723 ' HB3' HD23 ' A' ' 50' ' ' LEU . 4.0 pp -84.38 176.42 8.7 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 118.15 0.975 . . . . 0.0 110.377 167.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -138.2 163.37 31.88 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 128.7 2.8 . . . . 0.0 105.536 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.42 -5.79 15.1 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.244 1.021 . . . . 0.0 110.71 178.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 . . . . . 0 C--O 1.254 1.311 0 C-N-CA 130.169 3.387 . . . . 0.0 105.955 -177.329 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.511 0 N-CA-C 109.72 -1.352 . . . . 0.0 109.72 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 37.3 m80 -65.99 135.67 55.01 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 158.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.52 101.79 4.91 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 105.496 -2.038 . . . . 0.0 105.496 -162.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 25.8 mmtt -58.37 121.49 10.95 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -112.18 172.09 7.12 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.774 1.23 . . . . 0.0 107.793 174.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.88 152.69 49.08 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 124.492 1.117 . . . . 0.0 110.124 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -48.44 -41.38 29.18 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.496 1.118 . . . . 0.0 110.193 173.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -50.31 -63.58 1.08 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.406 2.282 . . . . 0.0 110.487 174.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.7 mm-40 -70.34 -32.9 70.83 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.835 2.054 . . . . 0.0 111.354 -172.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 88.2 mt -71.93 -33.94 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 124.613 1.165 . . . . 0.0 108.818 174.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.36 -46.71 63.74 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 125.157 1.361 . . . . 0.0 111.06 -174.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 65.0 t -67.84 -46.62 81.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 123.276 0.63 . . . . 0.0 109.433 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.7 mp -58.78 -51.91 67.95 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.563 0.745 . . . . 0.0 111.503 -179.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.63 -37.18 86.7 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.739 -0.648 . . . . 0.0 111.198 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.61 -28.6 72.07 Favored Glycine 0 CA--C 1.529 0.914 0 CA-C-N 118.79 0.723 . . . . 0.0 111.956 176.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mp -65.38 -24.93 67.36 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.35 -1.676 . . . . 0.0 112.44 176.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.42 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -78.57 -22.42 47.16 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 118.813 -0.613 . . . . 0.0 112.611 171.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.42 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.9 mp -130.1 92.12 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 125.519 1.528 . . . . 0.0 107.017 -172.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 65.16 63.78 1.08 Allowed Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 124.61 1.164 . . . . 0.0 111.594 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -59.31 -35.36 97.06 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.576 2.184 . . . . 0.0 111.165 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 71.4 mt-10 -68.86 -49.84 54.94 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 117.901 -1.047 . . . . 0.0 110.95 -175.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 59.5 t90 -52.22 -50.73 61.39 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 118.826 0.739 . . . . 0.0 109.796 173.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.1 tt -53.68 -59.27 4.83 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.3 mtpt -62.86 -32.66 73.94 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 117.86 -1.067 . . . . 0.0 112.372 -175.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -63.85 -48.51 76.46 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 120.228 1.376 . . . . 0.0 108.858 176.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -65.85 -34.35 77.94 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-O 118.384 -0.817 . . . . 0.0 111.883 -177.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.517 HG21 ' CD1' ' A' ' 130' ' ' TYR . 45.1 mm -61.77 -49.72 83.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 119.428 1.013 . . . . 0.0 109.37 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.73 -3.08 4.27 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.083 0.953 . . . . 0.0 113.324 177.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -111.84 -7.07 14.21 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 126.645 1.978 . . . . 0.0 112.378 172.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 1.9 t30 44.61 38.67 2.83 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 127.171 2.188 . . . . 0.0 111.203 -167.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.37 -5.07 19.29 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.491 1.517 . . . . 0.0 111.438 -175.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -80.62 138.61 36.44 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 -175.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 92.9 t -118.0 150.47 20.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 126.316 1.846 . . . . 0.0 106.784 175.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -124.82 142.83 51.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 129.258 3.023 . . . . 0.0 105.616 174.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -167.24 -178.95 39.88 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 27.8 mm -119.1 137.55 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 125.76 1.624 . . . . 0.0 106.83 -176.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.512 HG13 HG11 ' A' ' 61' ' ' VAL . 23.8 t -43.99 -71.98 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.725 1.21 . . . . 0.0 112.606 175.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 47.0 mttt 55.06 165.04 0.05 OUTLIER Pre-proline 0 CA--C 1.547 0.86 0 C-N-CA 125.708 1.603 . . . . 0.0 113.03 -164.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -78.84 -22.22 9.06 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 121.008 1.138 . . . . 0.0 111.009 175.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.9 m -77.29 19.56 0.33 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.189 1.796 . . . . 0.0 113.743 -172.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -132.8 177.89 7.29 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.598 1.559 . . . . 0.0 109.124 176.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.1 m -91.33 112.08 23.84 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.849 1.26 . . . . 0.0 107.902 173.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.512 HG11 HG13 ' A' ' 55' ' ' VAL . 5.7 m -144.47 162.23 40.37 Favored Pre-proline 0 CA--C 1.54 0.576 0 C-N-CA 123.665 0.786 . . . . 0.0 110.429 -177.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -73.25 -172.83 1.11 Allowed 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 123.315 2.677 . . . . 0.0 112.211 171.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.04 162.23 28.56 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.297 1.039 . . . . 0.0 111.552 165.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 68.32 33.64 78.2 Favored Glycine 0 CA--C 1.524 0.631 0 C-N-CA 123.93 0.776 . . . . 0.0 113.514 160.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.9 m -144.14 27.15 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 CA-C-N 118.39 1.095 . . . . 0.0 111.606 -177.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.79 -16.35 4.34 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -163.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -149.62 15.4 0.87 Allowed 'General case' 0 C--N 1.311 -1.095 0 C-N-CA 128.352 2.661 . . . . 0.0 110.424 -170.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -74.68 132.08 41.4 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 176.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 58.6 m -68.03 149.33 49.83 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 166.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -136.71 164.32 28.51 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.388 -0.82 . . . . 0.0 110.689 173.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 16.7 mt -139.23 135.88 34.39 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 126.968 2.107 . . . . 0.0 105.878 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.46 ' HB ' HG13 ' A' ' 81' ' ' ILE . 11.8 p -156.17 158.26 3.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 107.109 -1.441 . . . . 0.0 107.109 -174.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.412 ' HB3' ' H ' ' A' ' 76' ' ' ASP . . . -84.97 154.31 22.23 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 121.107 -0.996 . . . . 0.0 108.391 168.165 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.49 -16.01 62.86 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.452 -0.785 . . . . 0.0 112.9 175.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -104.03 -39.19 6.66 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.667 173.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.412 ' H ' ' HB3' ' A' ' 73' ' ' ALA . 1.7 m-20 -82.15 28.79 0.43 Allowed 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.634 1.174 . . . . 0.0 110.548 -167.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -49.71 -53.66 23.38 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 126.491 1.916 . . . . 0.0 110.534 -169.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -92.51 7.97 40.85 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.045 1.338 . . . . 0.0 113.045 176.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.2 -68.54 1.02 Allowed Glycine 0 CA--C 1.529 0.919 0 C-N-CA 126.263 1.887 . . . . 0.0 111.432 -176.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.7 m -134.8 143.09 46.88 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 118.814 1.307 . . . . 0.0 108.987 173.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.46 HG13 ' HB ' ' A' ' 72' ' ' VAL . 7.6 tt -143.44 157.89 16.96 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 171.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.2 mt -141.8 137.91 31.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 176.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -118.09 156.35 28.8 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 124.646 1.178 . . . . 0.0 108.64 176.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -161.02 158.47 27.94 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 120.997 -1.064 . . . . 0.0 110.593 174.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.53 110.16 4.67 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 166.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -85.24 124.71 32.19 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -151.87 150.79 30.48 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 127.307 2.243 . . . . 0.0 110.769 -177.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 46.42 53.4 9.66 Favored Glycine 0 CA--C 1.534 1.274 0 C-N-CA 124.872 1.225 . . . . 0.0 113.815 171.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 53.9 mm-40 57.73 12.11 1.54 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.498 1.919 . . . . 0.0 115.069 -172.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.5 m -128.08 170.23 13.17 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 128.443 2.697 . . . . 0.0 109.119 -168.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.6 p -156.05 109.59 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.689 0 O-C-N 121.003 -1.061 . . . . 0.0 112.616 174.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.665 HD12 ' H ' ' A' ' 92' ' ' ILE . 1.6 mp -79.03 95.38 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.646 0 N-CA-C 106.236 -1.764 . . . . 0.0 106.236 173.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 19.2 mt -76.34 128.16 37.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 165.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -118.02 110.75 18.05 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 126.366 1.866 . . . . 0.0 106.405 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.413 ' CD2' HG12 ' A' ' 36' ' ' ILE . 34.7 p90 -126.78 164.96 20.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.146 0.884 . . . . 0.0 112.913 -179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.6 t -148.75 172.03 15.26 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.958 1.703 . . . . 0.0 108.615 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 7.6 p -114.93 -1.41 13.13 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.729 1.612 . . . . 0.0 111.953 169.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -143.21 143.28 31.69 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 160.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.0 mtm180 -60.44 -10.87 5.46 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 113.696 0.999 . . . . 0.0 113.696 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -101.84 1.27 36.88 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 115.211 1.56 . . . . 0.0 115.211 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 21.8 p -113.24 156.36 23.43 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.132 0.967 . . . . 0.0 112.612 -174.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.3 tmtt? -64.68 132.69 50.39 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 125.847 1.659 . . . . 0.0 109.926 -168.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 7.4 mt -78.23 140.58 38.9 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -173.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -66.9 -174.33 0.32 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.676 1.19 . . . . 0.0 110.793 177.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.32 101.83 4.63 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 124.381 1.072 . . . . 0.0 108.996 178.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -121.29 113.24 19.65 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 103.81 -2.663 . . . . 0.0 103.81 174.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -126.58 106.1 9.18 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 116.319 -1.8 . . . . 0.0 108.031 -166.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 26.7 mt -128.2 154.7 45.52 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 120.71 1.595 . . . . 0.0 109.143 -158.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 22.1 p -73.79 147.21 43.62 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 121.258 1.845 . . . . 0.0 111.44 176.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 47.6 mt -46.7 -48.89 20.13 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 122.919 1.343 . . . . 0.0 109.77 167.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -71.24 -15.69 62.46 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.01 0.924 . . . . 0.0 112.281 -174.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -75.83 -56.47 4.64 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 171.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -55.14 -37.61 67.17 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.827 1.194 . . . . 0.0 111.834 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -56.83 -47.72 79.67 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 121.848 -0.533 . . . . 0.0 110.293 173.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -20.37 63.37 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 118.164 -0.922 . . . . 0.0 112.564 -176.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -83.01 -57.47 3.27 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.532 0.733 . . . . 0.0 110.952 175.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -116.28 0.94 13.0 Favored 'General case' 0 N--CA 1.464 0.255 0 O-C-N 121.391 -0.818 . . . . 0.0 113.064 -163.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.434 ' HA ' HE21 ' A' ' 123' ' ' GLN . 1.6 t80 -138.18 26.9 2.64 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -174.024 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.82 -26.96 40.33 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 174.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 66.2 p -80.09 -165.54 0.86 Allowed 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 119.187 0.903 . . . . 0.0 110.972 -168.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 24.7 ttm-85 -114.53 -33.3 5.61 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.486 1.114 . . . . 0.0 111.779 172.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.3 p -62.11 -48.09 81.72 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 126.311 1.845 . . . . 0.0 110.874 174.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.434 HE21 ' HA ' ' A' ' 118' ' ' TYR . 2.7 pm0 -58.03 -25.79 61.6 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -172.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.7 mttm -65.44 -4.43 5.71 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.018 1.327 . . . . 0.0 112.774 175.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -80.08 -83.51 0.1 Allowed 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 105.255 -2.128 . . . . 0.0 105.255 154.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 18.7 mp0 -55.01 -56.46 19.46 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 124.168 0.987 . . . . 0.0 113.533 -160.234 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.17 -21.77 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 124.131 0.972 . . . . 0.0 111.483 -175.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.62 -39.42 14.08 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.243 1.817 . . . . 0.0 109.924 177.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -59.55 -40.05 86.01 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 126.987 2.115 . . . . 0.0 110.667 174.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.517 ' CD1' HG21 ' A' ' 45' ' ' ILE . 17.8 m-30 -60.54 -33.08 72.14 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 125.201 1.4 . . . . 0.0 110.783 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 24.2 t -68.58 -13.9 17.74 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 O-C-N 121.583 -0.698 . . . . 0.0 110.772 175.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -116.08 17.64 15.74 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.286 1.434 . . . . 0.0 111.111 172.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -122.54 -10.61 5.91 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 126.214 1.864 . . . . 0.0 111.788 178.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.4 pp -73.31 165.74 24.48 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 124.412 1.085 . . . . 0.0 108.928 157.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 2.8 mtt-85 -110.81 162.49 14.74 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 127.426 2.29 . . . . 0.0 107.03 172.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.4 m -132.35 17.67 4.45 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.931 0.492 . . . . 0.0 110.376 176.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 . . . . . 0 C--O 1.25 1.122 0 C-N-CA 128.74 2.816 . . . . 0.0 108.15 -170.347 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.498 0 N-CA-C 109.13 -1.588 . . . . 0.0 109.13 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -58.08 -33.03 68.64 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 114.781 1.4 . . . . 0.0 114.781 -171.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 2.3 mtp 60.24 -167.34 0.18 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.362 0.665 . . . . 0.0 110.836 176.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -133.72 171.06 14.66 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 125.497 1.519 . . . . 0.0 108.619 164.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.6 m-85 -102.07 173.13 6.52 Favored 'General case' 0 C--O 1.239 0.536 0 C-N-CA 124.941 1.296 . . . . 0.0 108.387 172.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.2 p -135.51 150.92 49.91 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 125.134 1.373 . . . . 0.0 108.585 177.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.2 m-20 -57.35 -38.73 74.59 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.348 0.659 . . . . 0.0 110.819 -174.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -48.96 -61.28 2.14 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.465 2.306 . . . . 0.0 111.889 172.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.3 mm-40 -66.74 -40.05 88.18 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.989 1.716 . . . . 0.0 109.456 -172.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.415 HG21 ' HB2' ' A' ' 86' ' ' ALA . 67.3 mt -61.89 -35.49 68.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 173.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.77 -51.05 59.31 Favored Glycine 0 N--CA 1.448 -0.554 0 CA-C-O 118.187 -1.34 . . . . 0.0 111.232 178.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 76.3 t -58.3 -50.23 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 118.134 0.967 . . . . 0.0 109.18 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.4 mp -55.71 -49.82 71.99 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.259 1.024 . . . . 0.0 112.008 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.19 -42.78 93.25 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.919 -0.562 . . . . 0.0 111.32 -177.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.11 -25.24 74.54 Favored Glycine 0 C--N 1.337 0.629 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.095 176.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 tp -66.53 -24.15 66.34 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.307 -1.702 . . . . 0.0 111.74 176.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.425 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -77.92 -22.82 49.06 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 170.282 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.425 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.8 mp -136.59 101.34 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 C-N-CA 125.543 1.537 . . . . 0.0 106.927 -170.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.7 m 64.49 59.2 1.54 Allowed Pre-proline 0 CA--C 1.546 0.804 0 C-N-CA 124.73 1.212 . . . . 0.0 112.904 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -64.82 -43.21 12.94 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 123.33 2.687 . . . . 0.0 112.165 176.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -53.74 -55.28 27.72 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.467 1.03 . . . . 0.0 110.164 -177.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 63.0 t90 -53.33 -42.17 66.46 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 124.61 1.164 . . . . 0.0 110.714 176.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.59 -53.6 32.67 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 -174.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -58.15 -44.22 87.74 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 123.857 0.863 . . . . 0.0 110.69 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -55.8 -52.35 64.31 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.939 0.896 . . . . 0.0 109.919 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -71.37 -24.39 62.07 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.498 -0.763 . . . . 0.0 111.482 -174.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.46 HG21 ' HD1' ' A' ' 130' ' ' TYR . 24.5 mm -72.18 -38.75 63.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 CA-C-N 120.095 1.316 . . . . 0.0 110.579 167.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.09 -6.52 9.17 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.511 1.051 . . . . 0.0 112.756 -178.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -125.07 10.26 8.14 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.235 1.414 . . . . 0.0 112.267 167.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 50.67 27.44 2.98 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 128.78 2.832 . . . . 0.0 112.521 -178.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -82.77 -8.19 59.6 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 127.045 2.138 . . . . 0.0 112.823 -179.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 9.8 tp -76.5 147.43 37.81 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.537 1.062 . . . . 0.0 110.225 -175.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.9 t -123.89 159.36 29.12 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 C-N-CA 125.614 1.566 . . . . 0.0 107.782 170.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -129.65 144.54 51.33 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 128.669 2.787 . . . . 0.0 107.56 173.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -161.5 173.97 37.97 Favored Glycine 0 C--N 1.335 0.522 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 174.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 23.6 mm -106.3 147.77 11.42 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.127 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 168.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.631 HG13 HG11 ' A' ' 61' ' ' VAL . 26.7 t -50.72 -77.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 126.103 1.761 . . . . 0.0 112.346 173.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 38.3 mtmt 57.43 165.43 0.07 OUTLIER Pre-proline 0 CA--C 1.541 0.622 0 C-N-CA 126.477 1.911 . . . . 0.0 114.439 -170.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -78.83 64.62 8.76 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 123.078 2.518 . . . . 0.0 109.471 174.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 25.1 m -140.29 -17.02 0.92 Allowed 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 126.205 1.802 . . . . 0.0 112.728 -167.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -146.36 161.5 40.22 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 119.479 1.036 . . . . 0.0 108.985 -168.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 84.9 m -70.93 117.43 12.42 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 119.832 1.196 . . . . 0.0 107.969 173.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.631 HG11 HG13 ' A' ' 55' ' ' VAL . 30.4 m -139.96 159.37 64.76 Favored Pre-proline 0 C--O 1.236 0.352 0 C-N-CA 124.79 1.236 . . . . 0.0 109.161 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.491 ' HG3' HD21 ' A' ' 103' ' ' LEU . 83.9 Cg_endo -72.13 -178.44 3.23 Favored 'Trans proline' 0 N--CA 1.45 -1.057 0 C-N-CA 121.72 1.614 . . . . 0.0 109.882 169.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -73.09 163.34 28.3 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.355 169.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 82.79 16.83 69.33 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-O 118.201 -1.333 . . . . 0.0 114.067 166.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.2 m -141.35 19.06 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 CA-C-N 119.115 1.458 . . . . 0.0 113.427 -171.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 46.4 t0 -57.22 -12.72 2.49 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 127.101 2.16 . . . . 0.0 116.245 -167.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -142.99 14.78 1.9 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 125.489 1.516 . . . . 0.0 111.813 175.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -70.07 148.1 49.2 Favored 'General case' 0 C--O 1.234 0.271 0 O-C-N 121.181 -0.949 . . . . 0.0 108.993 176.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 64.3 m -72.89 157.79 36.76 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 124.14 0.976 . . . . 0.0 109.779 163.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -136.21 162.17 33.72 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.645 1.178 . . . . 0.0 110.146 163.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 10.1 mt -133.98 136.44 44.13 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 171.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.43 ' HB ' HG13 ' A' ' 81' ' ' ILE . 14.5 p -154.19 -177.99 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 N-CA-C 104.9 -2.259 . . . . 0.0 104.9 -179.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -132.38 158.44 41.94 Favored 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 120.527 -1.358 . . . . 0.0 110.412 175.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.83 -17.26 62.75 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 125.653 1.581 . . . . 0.0 114.65 -161.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -117.41 -19.37 9.54 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 123.332 0.653 . . . . 0.0 111.404 175.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -88.82 38.35 0.88 Allowed 'General case' 0 CA--C 1.537 0.48 0 O-C-N 120.818 -1.176 . . . . 0.0 109.995 -178.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -50.98 -52.34 43.65 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.189 -0.944 . . . . 0.0 112.894 -167.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -95.86 2.68 53.83 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.946 0.499 . . . . 0.0 111.456 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -73.43 -66.66 1.96 Allowed Glycine 0 CA--C 1.527 0.833 0 C-N-CA 125.323 1.439 . . . . 0.0 112.602 -169.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.2 m -144.55 154.1 42.52 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.801 1.24 . . . . 0.0 107.707 178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.43 HG13 ' HB ' ' A' ' 72' ' ' VAL . 6.6 tt -153.12 148.91 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-N 119.916 1.234 . . . . 0.0 108.161 174.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.484 HG23 ' HB3' ' A' ' 95' ' ' TYR . 24.0 mt -136.78 149.98 26.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 O-C-N 120.601 -1.312 . . . . 0.0 108.704 172.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -125.07 162.64 24.13 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 126.49 1.916 . . . . 0.0 109.369 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -162.16 160.36 27.08 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.103 -0.998 . . . . 0.0 111.777 175.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.8 tptm -142.88 111.34 6.21 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.907 0.883 . . . . 0.0 109.009 161.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HB2' HG21 ' A' ' 28' ' ' ILE . . . -81.86 102.74 11.04 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 173.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -96.2 90.49 5.51 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 126.389 1.876 . . . . 0.0 106.385 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 62.91 -137.4 43.93 Favored Glycine 0 CA--C 1.528 0.904 0 N-CA-C 110.549 -1.02 . . . . 0.0 110.549 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.71 5.22 0.13 Allowed 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 116.473 -1.727 . . . . 0.0 115.187 -179.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.0 157.21 44.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 121.657 2.026 . . . . 0.0 110.61 -175.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 4.4 p -137.12 118.65 18.44 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.734 0 O-C-N 120.908 -1.12 . . . . 0.0 113.552 177.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 13.5 mm -78.5 94.05 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 106.173 -1.788 . . . . 0.0 106.173 172.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.421 ' CD1' HD23 ' A' ' 108' ' ' LEU . 27.1 mt -67.68 125.5 25.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 164.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.7 mttt -121.69 95.36 4.64 Favored 'General case' 0 CA--C 1.531 0.243 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 176.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.484 ' HB3' HG23 ' A' ' 82' ' ' ILE . 51.3 p90 -110.11 163.71 13.33 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.563 -1.336 . . . . 0.0 111.653 -177.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -147.23 166.73 26.14 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 170.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.3 p -98.24 -12.09 21.98 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.355 1.462 . . . . 0.0 111.108 171.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -140.13 132.88 29.02 Favored 'General case' 0 N--CA 1.447 -0.609 0 C-N-CA 123.924 0.89 . . . . 0.0 108.714 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.9 ttt180 -55.38 -25.67 36.76 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.04 1.336 . . . . 0.0 112.208 177.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -83.14 -5.29 59.06 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 118.293 2.701 . . . . 0.0 118.293 -178.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 2.6 p -116.71 161.53 19.1 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 119.488 1.04 . . . . 0.0 113.774 -169.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 7.1 tmtt? -64.76 153.08 40.91 Favored 'General case' 0 C--N 1.346 0.419 0 C-N-CA 123.249 0.62 . . . . 0.0 109.71 179.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.491 HD21 ' HG3' ' A' ' 62' ' ' PRO . 1.4 mm? -88.01 139.58 30.37 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.211 0.529 . . . . 0.0 109.694 -174.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -61.45 174.32 0.76 Allowed 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 123.961 0.904 . . . . 0.0 109.713 164.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -132.4 124.47 28.74 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 174.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -127.87 123.13 34.32 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 162.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -97.08 127.85 43.45 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 114.894 -2.479 . . . . 0.0 106.31 172.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.421 HD23 ' CD1' ' A' ' 93' ' ' ILE . 4.0 mm? -124.69 137.45 54.35 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 122.813 2.551 . . . . 0.0 108.479 179.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.9 p -64.6 148.43 50.87 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.213 172.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.5 mt -49.62 -42.21 44.34 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-O 121.35 0.595 . . . . 0.0 109.939 165.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 15.6 t -62.63 -45.77 91.32 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.459 -177.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -52.26 -61.02 2.54 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-N 118.551 0.614 . . . . 0.0 110.428 175.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 80.7 mt -61.79 -32.62 72.92 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.714 0.265 . . . . 0.0 111.714 -171.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -66.12 -40.8 90.97 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 121.546 -0.721 . . . . 0.0 110.052 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.44 -49.53 40.72 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-O 117.636 -1.173 . . . . 0.0 110.752 -177.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -55.16 -57.16 12.88 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 126.211 1.804 . . . . 0.0 108.367 177.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -118.55 16.49 13.73 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -159.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.509 ' CE1' ' HA ' ' A' ' 124' ' ' LYS . 1.5 t80 -147.21 26.59 1.07 Allowed 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 -179.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.605 ' NE2' HE22 ' A' ' 123' ' ' GLN 0.272 0.0 OUTLIER -79.4 -52.96 7.39 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 120.891 -1.131 . . . . 0.0 113.793 -178.146 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.0 p -85.13 159.46 20.15 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 120.72 1.6 . . . . 0.0 111.638 -172.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -63.27 -45.05 93.3 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 116.774 -1.584 . . . . 0.0 113.932 176.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 2.7 t -61.49 -39.73 92.0 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 120.152 1.342 . . . . 0.0 108.815 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.605 HE22 ' NE2' ' A' ' 119' ' ' GLN . 11.7 tt0 -56.18 -39.21 72.03 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -178.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.509 ' HA ' ' CE1' ' A' ' 118' ' ' TYR . 7.0 mtpm? -58.54 -37.28 75.35 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 118.361 -0.828 . . . . 0.0 112.88 178.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.7 -60.92 2.15 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 -178.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.32 -52.79 33.75 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 125.253 1.421 . . . . 0.0 111.249 -177.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 91.1 t -55.67 -48.97 77.09 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 124.167 0.987 . . . . 0.0 111.194 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -67.12 -31.88 72.64 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.484 0.714 . . . . 0.0 111.663 179.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.31 -41.76 97.53 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.758 1.623 . . . . 0.0 109.913 175.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.46 ' HD1' HG21 ' A' ' 45' ' ' ILE . 40.5 m-85 -61.01 -38.44 86.09 Favored 'General case' 0 C--N 1.342 0.269 0 C-N-CA 122.86 0.464 . . . . 0.0 112.102 177.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.3 t -64.07 -41.39 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.695 0.68 . . . . 0.0 109.793 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -71.37 -13.16 61.77 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 177.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -102.2 11.5 57.07 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 125.086 1.327 . . . . 0.0 113.541 -171.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.5 pp -117.22 173.17 6.83 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.108 0.963 . . . . 0.0 110.201 174.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 74.4 mtp180 -125.78 167.87 14.59 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 125.231 1.412 . . . . 0.0 108.174 -171.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.91 -6.12 6.18 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 122.306 1.05 . . . . 0.0 113.06 -175.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.061 1 C-N-CA 131.808 4.043 . . . . 0.0 104.983 -174.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.818 0 N-CA-C 111.511 -0.635 . . . . 0.0 111.511 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.97 -14.53 4.42 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -170.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -146.51 91.07 2.0 Allowed 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.707 1.594 . . . . 0.0 110.485 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? 59.46 -179.02 0.09 Allowed 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 126.067 1.747 . . . . 0.0 111.552 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 59.3 -175.06 0.1 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.926 1.691 . . . . 0.0 109.82 -166.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -120.31 149.51 42.2 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 165.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -62.39 -35.38 79.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.787 0.327 . . . . 0.0 110.69 -163.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -43.27 92.87 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.315 0.646 . . . . 0.0 109.907 -178.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 -61.32 -36.48 80.23 Favored 'General case' 0 C--N 1.343 0.296 0 C-N-CA 123.257 0.623 . . . . 0.0 109.75 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 64.5 mt -69.2 -45.4 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -59.7 -36.58 90.23 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-O 119.257 -0.746 . . . . 0.0 113.468 -175.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.75 -48.7 85.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 CA-C-N 117.732 0.766 . . . . 0.0 109.501 174.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 90.9 mt -62.89 -44.21 96.7 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 118.719 0.691 . . . . 0.0 110.279 -178.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.62 -43.92 72.67 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.763 0.825 . . . . 0.0 109.775 175.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.99 -35.3 78.5 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 109.995 -1.242 . . . . 0.0 109.995 179.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.7 mp -62.62 -18.19 61.76 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 120.274 2.037 . . . . 0.0 112.271 179.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.422 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -86.23 -17.38 34.92 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.633 1.573 . . . . 0.0 114.072 171.433 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.422 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.9 mp -135.91 96.21 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 126.883 2.073 . . . . 0.0 106.902 -177.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 58.99 73.59 0.68 Allowed Pre-proline 0 CA--C 1.543 0.712 0 C-N-CA 127.59 2.356 . . . . 0.0 112.388 -178.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -60.34 -46.14 19.46 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 123.724 2.949 . . . . 0.0 111.916 172.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -62.33 -27.78 69.28 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.257 0.623 . . . . 0.0 112.042 -174.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -65.03 -65.13 0.71 Allowed 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.286 -0.884 . . . . 0.0 109.024 172.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 tt -52.16 -47.54 65.4 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.0 0.92 . . . . 0.0 110.724 -174.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.8 mtpm? -59.9 -46.94 87.74 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.65 0.78 . . . . 0.0 110.391 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.7 mt-30 -61.51 -41.7 97.7 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 119.092 0.86 . . . . 0.0 111.501 173.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -61.03 -49.07 78.88 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.788 0.722 . . . . 0.0 109.171 -176.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 21.5 mm -61.52 -34.35 61.2 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 C-N-CA 123.938 0.895 . . . . 0.0 110.478 177.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.11 -9.01 19.28 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.933 -1.105 . . . . 0.0 112.931 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -123.46 10.7 9.19 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.305 1.042 . . . . 0.0 112.42 167.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 52.12 34.49 14.33 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 126.065 1.746 . . . . 0.0 111.938 -175.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -87.64 -0.64 57.16 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 126.941 2.097 . . . . 0.0 114.638 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 61.4 tp -90.69 134.51 34.36 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.371 1.068 . . . . 0.0 109.306 -171.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 53.8 t -118.63 153.53 20.83 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 126.062 1.745 . . . . 0.0 108.053 174.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 57.6 t80 -135.26 148.19 49.49 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 127.724 2.41 . . . . 0.0 107.451 -175.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -163.38 173.4 39.51 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 170.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 25.4 mm -95.9 148.1 5.52 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.117 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 161.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.474 HG13 HG21 ' A' ' 61' ' ' VAL . 21.5 t -44.59 -59.19 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.424 0 C-N-CA 126.752 2.021 . . . . 0.0 113.647 178.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 23.5 mttt 58.77 165.41 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 126.348 1.859 . . . . 0.0 113.522 -176.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -73.76 -25.29 14.73 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 121.837 1.691 . . . . 0.0 111.749 174.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.41 63.77 0.98 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.093 1.757 . . . . 0.0 110.399 -170.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -158.09 -169.23 2.73 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 127.482 2.313 . . . . 0.0 106.752 169.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 20.5 m -118.97 110.46 17.15 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 120.271 1.396 . . . . 0.0 108.725 172.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.474 HG21 HG13 ' A' ' 55' ' ' VAL . 31.6 m -135.44 163.09 53.32 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 124.89 1.276 . . . . 0.0 112.138 -175.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -75.61 172.86 15.5 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.111 3.207 . . . . 0.0 112.266 172.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.74 135.39 40.33 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.766 0.826 . . . . 0.0 111.038 -179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 84.77 45.13 6.14 Favored Glycine 0 CA--C 1.522 0.523 0 C-N-CA 125.326 1.441 . . . . 0.0 113.163 168.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 2.7 m -138.84 38.61 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 125.874 1.67 . . . . 0.0 109.392 173.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -65.47 -15.96 63.17 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 -148.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -148.27 17.14 1.06 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 127.572 2.349 . . . . 0.0 111.344 175.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.514 ' CG ' ' HB2' ' A' ' 85' ' ' LYS . 3.4 m-85 -61.6 152.66 29.97 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 122.017 0.913 . . . . 0.0 109.358 177.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m -75.01 153.97 38.24 Favored 'General case' 0 N--CA 1.437 -1.09 0 C-N-CA 126.32 1.848 . . . . 0.0 108.706 165.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 33.9 p90 -137.36 163.62 30.58 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.39 1.076 . . . . 0.0 110.69 167.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 28.4 mt -141.83 133.05 26.35 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 127.422 2.289 . . . . 0.0 106.726 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.415 ' HB ' HG13 ' A' ' 81' ' ' ILE . 8.8 p -159.05 159.63 2.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 C-N-CA 124.349 1.06 . . . . 0.0 108.672 -175.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.403 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -86.93 146.85 26.0 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-N 119.095 0.861 . . . . 0.0 109.905 177.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.28 -10.69 11.71 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 126.676 1.991 . . . . 0.0 114.024 176.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -136.36 -6.95 2.0 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 125.678 1.591 . . . . 0.0 113.395 -169.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.403 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 33.5 t70 -130.14 37.61 3.88 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 125.931 1.692 . . . . 0.0 107.512 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -49.18 -39.3 28.85 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 123.332 0.653 . . . . 0.0 111.531 -173.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -90.1 -7.15 54.48 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.594 1.157 . . . . 0.0 112.574 -174.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.62 -65.86 1.39 Allowed Glycine 0 C--N 1.334 0.461 0 C-N-CA 124.426 1.012 . . . . 0.0 111.895 -167.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.99 128.04 33.57 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 -171.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.415 HG13 ' HB ' ' A' ' 72' ' ' VAL . 4.0 tt -137.58 149.36 25.45 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 176.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.473 HG23 ' HB3' ' A' ' 95' ' ' TYR . 45.4 mt -133.64 138.11 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 N-CA-C 106.642 -1.614 . . . . 0.0 106.642 172.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -111.06 152.24 27.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 126.298 1.839 . . . . 0.0 106.828 172.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 50.1 p90 -154.11 163.43 40.11 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 121.171 -0.955 . . . . 0.0 108.821 171.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.514 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -146.94 109.81 4.68 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 173.426 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -77.06 82.36 3.57 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 124.417 1.087 . . . . 0.0 108.702 179.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -74.14 179.53 4.39 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.232 2.213 . . . . 0.0 109.32 172.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.84 117.48 6.68 Favored Glycine 0 CA--C 1.531 1.042 0 O-C-N 120.533 -1.354 . . . . 0.0 112.127 176.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 53.68 11.45 0.31 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 127.582 2.353 . . . . 0.0 114.267 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 3.3 m -143.78 159.33 42.7 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 120.288 1.404 . . . . 0.0 109.151 -166.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 25.0 t -133.82 116.73 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 167.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.45 ' N ' HD12 ' A' ' 92' ' ' ILE . 2.5 mp -84.36 102.6 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 168.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 13.5 mt -84.45 134.39 27.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 175.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -134.18 97.98 4.0 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.755 1.622 . . . . 0.0 108.465 -175.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.473 ' HB3' HG23 ' A' ' 82' ' ' ILE . 40.9 p90 -122.57 168.49 12.1 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 120.612 -1.305 . . . . 0.0 110.554 -172.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.9 t -153.1 167.24 29.9 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.509 1.124 . . . . 0.0 109.045 -173.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.5 p -88.77 -15.25 35.14 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.501 0.72 . . . . 0.0 112.422 166.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -150.53 147.03 26.98 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.541 0.736 . . . . 0.0 110.683 -170.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.33 11.2 0.09 Allowed 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 126.366 1.866 . . . . 0.0 113.546 176.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -136.44 10.13 3.19 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 117.219 2.304 . . . . 0.0 117.219 -177.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -116.33 158.74 22.95 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.152 0.501 . . . . 0.0 110.509 179.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.15 131.02 42.94 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 -175.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.457 ' H ' HD22 ' A' ' 103' ' ' LEU . 1.8 mm? -64.3 146.32 54.58 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.294 0.569 . . . . 0.0 110.065 -177.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 10.5 mptt -59.69 172.1 0.77 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.168 0.987 . . . . 0.0 109.936 163.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -130.23 108.24 9.88 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 124.188 0.995 . . . . 0.0 108.445 168.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -116.96 85.09 2.26 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 104.17 -2.53 . . . . 0.0 104.17 172.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -79.73 137.77 37.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 107.009 -1.478 . . . . 0.0 107.009 171.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 73.6 mt -143.9 147.79 34.5 Favored 'General case' 0 CA--C 1.513 -0.45 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 -178.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.86 149.77 39.44 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 118.432 0.56 . . . . 0.0 110.554 171.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 23.8 mt -56.43 -38.07 71.07 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.658 0.783 . . . . 0.0 110.528 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 4.3 t -55.37 -42.59 74.14 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.794 177.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -56.59 19.49 Favored 'General case' 0 C--N 1.343 0.302 0 C-N-CA 123.495 0.718 . . . . 0.0 110.189 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 59.0 mt -55.0 -39.97 69.63 Favored 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 122.771 0.429 . . . . 0.0 111.206 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 3.0 tmtm? -69.95 -37.97 75.99 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 122.795 0.438 . . . . 0.0 110.915 -178.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -29.29 64.23 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.565 1.146 . . . . 0.0 111.156 177.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -88.83 -42.86 11.63 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 118.045 -0.978 . . . . 0.0 112.174 -169.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -133.14 14.89 4.21 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.895 0.771 . . . . 0.0 112.754 -176.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -135.83 26.95 3.32 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.637 -1.289 . . . . 0.0 112.892 177.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 7.9 pm0 -93.2 -21.52 19.59 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 126.774 2.03 . . . . 0.0 113.28 -174.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 1.9 p -87.61 -167.74 1.99 Allowed 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 118.912 0.778 . . . . 0.0 110.324 -175.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 15.5 mmp_? -103.38 -43.31 5.46 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.72 0.808 . . . . 0.0 110.169 161.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -64.15 -22.65 67.02 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -175.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.8 pm0 -65.08 -24.89 67.58 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 120.355 1.434 . . . . 0.0 110.981 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -65.9 -7.45 16.64 Favored 'General case' 0 N--CA 1.464 0.251 0 O-C-N 121.458 -0.776 . . . . 0.0 111.938 174.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.91 -75.86 0.24 Allowed 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 107.034 -1.469 . . . . 0.0 107.034 157.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -55.17 -55.6 29.38 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 113.736 1.014 . . . . 0.0 113.736 -166.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 57.8 t -58.83 -54.08 38.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 124.569 1.148 . . . . 0.0 109.754 -178.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.27 -26.1 67.54 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 177.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -74.25 -42.56 59.46 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 125.036 1.335 . . . . 0.0 110.393 176.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -57.25 -41.7 80.12 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.252 0.621 . . . . 0.0 110.205 172.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 25.7 t -70.88 -30.12 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 O-C-N 121.175 -0.953 . . . . 0.0 111.126 177.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -77.54 -15.56 59.19 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.762 0.825 . . . . 0.0 112.596 175.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -105.92 7.2 41.22 Favored Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.919 1.723 . . . . 0.0 112.376 -172.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.91 146.69 27.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 118.563 1.182 . . . . 0.0 110.054 -172.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 12.7 mtt-85 -111.54 155.45 23.27 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 126.98 2.112 . . . . 0.0 109.427 -173.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 3.3 m -131.51 23.56 4.74 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 122.145 0.974 . . . . 0.0 110.744 -176.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 . . . . . 0 C--O 1.251 1.16 0 C-N-CA 128.696 2.799 . . . . 0.0 112.243 161.161 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.802 0 N-CA-C 110.36 -1.096 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -86.77 -19.08 29.6 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 125.992 1.717 . . . . 0.0 112.658 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.6 mmm -67.08 131.9 46.77 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 118.389 0.541 . . . . 0.0 109.611 -176.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.1 tttt 62.42 -171.34 0.16 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 126.597 1.959 . . . . 0.0 112.489 -179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.2 m-30 -60.9 167.64 2.76 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 166.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.8 p -135.6 166.97 21.99 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 177.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 -57.44 -36.79 71.83 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 122.844 0.458 . . . . 0.0 110.618 -176.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -49.5 74.77 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.92 1.288 . . . . 0.0 110.858 178.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.9 mm-40 -58.56 -39.77 81.2 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.204 1.002 . . . . 0.0 109.69 -175.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 85.9 mt -72.17 -36.49 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.699 0 C-N-CA 124.856 1.262 . . . . 0.0 109.809 -176.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -57.01 -33.72 64.53 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 123.653 0.644 . . . . 0.0 112.813 178.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.2 t -65.06 -55.8 18.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 CA-C-N 118.146 0.973 . . . . 0.0 109.193 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.92 -42.22 75.75 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.98 0.912 . . . . 0.0 111.772 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -56.45 -51.05 69.88 Favored 'General case' 0 N--CA 1.448 -0.561 0 C-N-CA 126.35 1.86 . . . . 0.0 110.799 173.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.52 -25.65 75.3 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 123.264 0.459 . . . . 0.0 112.678 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 74.2 mt -67.49 -20.29 65.44 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 119.575 1.688 . . . . 0.0 112.412 176.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -81.48 -17.39 48.82 Favored 'General case' 0 CA--C 1.53 0.2 0 O-C-N 121.637 -0.664 . . . . 0.0 112.702 169.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.9 mm -142.95 101.1 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 N-CA-C 106.519 -1.659 . . . . 0.0 106.519 -158.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.2 m 55.8 54.47 9.07 Favored Pre-proline 0 CA--C 1.544 0.729 0 C-N-CA 123.295 0.638 . . . . 0.0 112.599 -175.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.64 -40.64 44.92 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.121 2.548 . . . . 0.0 111.028 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -65.43 -47.78 75.04 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.774 -0.579 . . . . 0.0 110.29 -170.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 31.0 t90 -48.23 -45.88 34.75 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 126.61 1.964 . . . . 0.0 110.396 170.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.493 HD12 ' C ' ' A' ' 41' ' ' LEU . 0.2 OUTLIER -67.16 -46.29 74.47 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 -166.229 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -62.91 -37.73 88.15 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 117.05 -1.452 . . . . 0.0 111.552 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -59.22 -48.43 81.65 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 120.231 1.378 . . . . 0.0 108.989 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -64.9 -40.93 95.86 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-O 118.433 -0.794 . . . . 0.0 111.001 -172.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.9 mm -63.72 -44.81 98.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 119.284 0.947 . . . . 0.0 110.556 173.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.94 -11.25 26.64 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -116.51 7.6 13.77 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.297 1.439 . . . . 0.0 112.008 174.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 46.12 34.38 2.07 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 128.295 2.638 . . . . 0.0 112.969 -175.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.2 mm-40 -82.66 -13.54 56.26 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 125.7 1.6 . . . . 0.0 113.863 -177.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.6 tp -93.71 123.62 37.17 Favored 'General case' 0 C--O 1.236 0.37 0 O-C-N 121.584 -0.698 . . . . 0.0 110.228 -156.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 79.0 t -104.36 140.71 21.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.441 0 C-N-CA 124.541 1.136 . . . . 0.0 108.176 173.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -108.36 151.35 26.13 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 129.141 2.976 . . . . 0.0 106.841 169.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -165.4 173.9 41.17 Favored Glycine 0 N--CA 1.451 -0.306 0 O-C-N 121.517 -0.74 . . . . 0.0 111.658 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 35.6 mm -107.8 143.37 18.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 163.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.726 HG13 HG11 ' A' ' 61' ' ' VAL . 27.2 t -48.5 -60.82 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 C-N-CA 125.73 1.612 . . . . 0.0 113.703 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 43.2 mttt 60.63 165.92 0.09 OUTLIER Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 125.866 1.666 . . . . 0.0 113.262 -170.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -72.7 -7.43 20.78 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.14 1.894 . . . . 0.0 112.514 171.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.1 m -70.04 -34.85 73.77 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.584 0.754 . . . . 0.0 112.437 -177.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -107.17 167.59 9.8 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 119.005 0.82 . . . . 0.0 112.163 -160.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.9 m -89.17 103.82 16.41 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 124.071 0.948 . . . . 0.0 109.555 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.726 HG11 HG13 ' A' ' 55' ' ' VAL . 28.9 m -140.45 156.58 69.47 Favored Pre-proline 0 CA--C 1.537 0.475 0 C-N-CA 123.602 0.761 . . . . 0.0 111.899 -164.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -71.84 179.28 4.93 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 122.649 2.233 . . . . 0.0 110.149 172.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.9 162.76 27.84 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 123.741 0.816 . . . . 0.0 110.228 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.8 13.56 82.99 Favored Glycine 0 CA--C 1.529 0.918 0 CA-C-O 118.907 -0.941 . . . . 0.0 113.376 171.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.659 ' O ' HG11 ' A' ' 55' ' ' VAL . 12.7 m -146.38 75.03 0.11 Allowed 'Isoleucine or valine' 0 C--O 1.216 -0.694 0 C-N-CA 125.685 1.594 . . . . 0.0 108.956 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -89.53 -15.29 33.28 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 119.964 -1.71 . . . . 0.0 113.183 173.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -150.81 5.72 0.51 Allowed 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 125.528 1.531 . . . . 0.0 110.933 -161.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.2 m-85 -69.42 144.33 53.37 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 106.946 -1.501 . . . . 0.0 106.946 167.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 38.5 m -71.01 163.26 27.94 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.309 163.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -142.46 166.95 23.26 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.994 0.918 . . . . 0.0 111.118 169.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 20.4 mt -142.15 134.48 27.83 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 127.338 2.255 . . . . 0.0 107.55 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.6 p -160.95 157.64 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 C-N-CA 125.992 1.717 . . . . 0.0 106.648 -171.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.465 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -77.0 157.39 31.22 Favored 'General case' 0 C--O 1.233 0.215 0 O-C-N 121.022 -1.049 . . . . 0.0 109.022 167.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.07 -11.35 60.82 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 118.149 -0.929 . . . . 0.0 112.78 169.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -136.49 21.74 3.15 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.623 1.569 . . . . 0.0 110.896 -171.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.465 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 33.4 m-20 -140.71 43.98 1.83 Allowed 'General case' 0 N--CA 1.471 0.624 0 O-C-N 120.321 -1.487 . . . . 0.0 107.785 172.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -61.89 -48.33 80.96 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.1 -1.0 . . . . 0.0 110.654 -172.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -76.05 -3.67 37.1 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.48 -98.21 0.8 Allowed Glycine 0 CA--C 1.528 0.85 0 C-N-CA 124.162 0.887 . . . . 0.0 112.166 -173.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 19.4 m -104.79 151.06 24.23 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.487 -1.008 . . . . 0.0 109.405 -175.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.8 tt -153.83 154.41 7.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-N 119.256 0.934 . . . . 0.0 109.339 165.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 53.6 mt -130.25 127.05 62.5 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 171.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -102.67 155.79 18.07 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.03 1.332 . . . . 0.0 107.919 168.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 7.0 p90 -161.15 153.89 20.77 Favored 'General case' 0 N--CA 1.467 0.378 0 O-C-N 120.913 -1.117 . . . . 0.0 109.757 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.0 tttt -142.38 119.96 11.76 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 172.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.48 140.66 32.19 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 124.036 0.835 . . . . 0.0 109.077 169.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -134.72 84.09 2.08 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.212 1.805 . . . . 0.0 108.075 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 73.63 -49.06 1.63 Allowed Glycine 0 CA--C 1.529 0.956 0 C-N-CA 125.969 1.747 . . . . 0.0 113.237 175.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.405 ' O ' ' HG ' ' A' ' 110' ' ' LEU . 48.9 mt-30 -142.06 -43.51 0.34 Allowed 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 126.96 2.104 . . . . 0.0 110.308 166.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 4.4 m -78.75 126.21 30.41 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 120.226 -1.546 . . . . 0.0 109.719 -165.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 23.8 t -105.65 113.39 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.1 mp -83.32 95.19 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 169.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 6.5 mt -76.55 117.51 21.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 172.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -113.08 83.7 1.87 Allowed 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.467 1.907 . . . . 0.0 107.865 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.2 p90 -102.3 166.91 10.31 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 120.396 -1.44 . . . . 0.0 110.837 -177.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 13.7 t -136.06 177.88 7.49 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 169.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.8 p -128.31 -3.07 5.6 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 126.228 1.811 . . . . 0.0 110.683 171.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -147.24 142.46 27.24 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 157.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 39.1 mmm-85 -57.74 -34.26 69.33 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.504 0.721 . . . . 0.0 112.834 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -74.76 13.6 0.62 Allowed 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -179.049 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 35.0 p -132.92 158.89 41.47 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 119.482 1.037 . . . . 0.0 110.401 171.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.54 174.24 1.04 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-O 122.253 1.025 . . . . 0.0 110.968 171.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -83.66 149.57 26.43 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.653 -178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -177.39 0.39 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.224 1.81 . . . . 0.0 108.35 156.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -154.14 94.6 1.75 Allowed 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.006 -1.059 . . . . 0.0 111.558 -179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.7 tptt -101.43 119.98 39.59 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 173.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -114.44 123.42 49.39 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.922 1.289 . . . . 0.0 109.014 -178.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 24.7 mt -142.84 141.42 31.59 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.322 1.049 . . . . 0.0 109.299 -168.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 1.3 p -78.78 148.71 32.85 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 120.411 1.459 . . . . 0.0 111.62 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 89' ' ' GLN . 9.7 mt -56.44 -30.82 63.32 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 120.855 -1.153 . . . . 0.0 111.937 -179.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.61 -46.92 77.46 Favored 'General case' 0 N--CA 1.436 -1.138 0 C-N-CA 124.257 1.023 . . . . 0.0 110.981 177.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -55.07 -59.56 4.59 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 117.575 -1.202 . . . . 0.0 108.99 168.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -48.09 -45.21 32.4 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.423 1.01 . . . . 0.0 111.538 -176.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -69.96 -30.94 68.42 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.47 0.708 . . . . 0.0 111.834 -177.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -65.89 0.63 Allowed 'General case' 0 C--N 1.323 -0.548 0 O-C-N 120.758 -1.214 . . . . 0.0 107.873 169.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -44.54 -51.61 8.75 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 127.535 2.334 . . . . 0.0 110.311 -172.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -125.18 13.25 8.32 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 124.132 0.973 . . . . 0.0 111.932 -166.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.433 ' CD1' ' HB2' ' A' ' 123' ' ' GLN . 0.1 OUTLIER -136.44 15.52 3.19 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 119.985 1.266 . . . . 0.0 112.375 172.611 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.521 HE21 ' NE2' ' A' ' 123' ' ' GLN 0.261 0.2 OUTLIER -62.11 -45.12 94.87 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 178.725 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -73.35 -176.11 2.13 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 119.934 1.243 . . . . 0.0 110.579 -164.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.45 -25.02 39.16 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 119.197 -2.189 . . . . 0.0 111.29 170.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -85.35 -22.13 28.6 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 125.139 1.376 . . . . 0.0 109.563 -166.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.521 ' NE2' HE21 ' A' ' 119' ' ' GLN . 2.3 mm-40 -54.94 -33.53 62.35 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.994 0.918 . . . . 0.0 110.644 173.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.84 -3.42 2.43 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.968 1.707 . . . . 0.0 113.109 178.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.06 -2.41 2.56 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 128.35 2.66 . . . . 0.0 111.903 -175.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -112.08 -70.18 0.82 Allowed 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 124.974 1.309 . . . . 0.0 108.174 174.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 42.6 t -49.33 -58.26 1.43 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 C-N-CA 124.915 1.286 . . . . 0.0 108.901 176.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.14 -18.46 58.17 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -179.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -85.08 -43.23 14.08 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 125.84 1.656 . . . . 0.0 111.275 -178.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -62.93 -34.49 77.57 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.25 0.62 . . . . 0.0 110.298 177.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 17.2 t -66.04 -16.73 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 O-C-N 121.051 -1.031 . . . . 0.0 111.167 173.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -106.58 2.48 26.1 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.408 1.483 . . . . 0.0 111.902 176.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -114.56 -6.68 19.33 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 124.474 1.035 . . . . 0.0 112.692 178.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -80.05 169.9 17.2 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.541 1.17 . . . . 0.0 110.229 173.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 14.1 mtt-85 -124.5 162.56 23.72 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.635 1.974 . . . . 0.0 106.898 175.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.4 m -132.75 11.18 4.36 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 118.581 0.628 . . . . 0.0 111.807 -175.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 C--O 1.252 1.207 0 C-N-CA 124.208 1.003 . . . . 0.0 108.404 -157.321 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.749 0 CA-C-O 119.895 -0.392 . . . . 0.0 113.024 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -140.29 144.86 36.63 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.577 1.151 . . . . 0.0 108.05 171.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 21.8 ptt? -148.05 176.57 10.09 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 124.583 1.153 . . . . 0.0 110.686 -172.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.6 ptmt -143.26 163.98 31.47 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 126.292 1.837 . . . . 0.0 106.699 173.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 62.25 164.6 0.1 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 128.084 2.554 . . . . 0.0 112.421 -173.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.1 p -88.13 159.87 18.02 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 173.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -48.54 -47.8 39.01 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.864 0.866 . . . . 0.0 110.488 173.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -55.08 32.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.867 0.867 . . . . 0.0 110.374 -179.08 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -58.97 -43.87 91.43 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.734 1.613 . . . . 0.0 110.396 -173.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 85.1 mt -60.89 -45.27 98.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 C-N-CA 125.521 1.528 . . . . 0.0 108.592 178.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -61.74 -35.12 90.76 Favored Glycine 0 CA--C 1.521 0.443 0 C-N-CA 124.206 0.907 . . . . 0.0 112.908 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.405 HG21 HG22 ' A' ' 131' ' ' VAL . 93.4 t -66.23 -51.8 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.107 0 CA-C-N 118.161 0.981 . . . . 0.0 108.634 177.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.35 -40.52 97.51 Favored 'General case' 0 CA--C 1.522 -0.097 0 O-C-N 121.947 -0.471 . . . . 0.0 111.661 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.17 -34.56 76.65 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.469 -0.3 . . . . 0.0 110.576 175.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.22 -28.65 57.8 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.635 -0.986 . . . . 0.0 110.635 -179.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.3 mt -63.16 -27.08 69.12 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.059 1.429 . . . . 0.0 111.247 170.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.432 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -74.13 -21.67 59.77 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.118 -0.988 . . . . 0.0 111.939 174.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.432 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.7 mp -131.07 91.92 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 125.558 1.543 . . . . 0.0 108.755 -171.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 64.18 67.5 0.92 Allowed Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 125.426 1.49 . . . . 0.0 110.041 -178.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -64.25 -33.19 60.72 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.716 2.277 . . . . 0.0 111.528 177.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -65.16 -48.02 74.99 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 117.56 -1.209 . . . . 0.0 110.32 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 57.3 t90 -48.7 -61.49 2.01 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.651 0.78 . . . . 0.0 109.912 168.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.419 HD22 HD11 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -45.45 -58.27 3.48 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.137 1.775 . . . . 0.0 109.94 -177.413 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -63.07 -44.58 95.4 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.787 1.235 . . . . 0.0 111.651 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -62.06 -32.88 73.45 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 119.372 0.987 . . . . 0.0 111.08 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -65.59 -50.34 65.46 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 176.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 41.8 mm -60.18 -36.59 69.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 118.518 0.599 . . . . 0.0 111.203 177.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.34 -12.42 21.0 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 118.675 0.67 . . . . 0.0 112.693 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.62 19.8 7.28 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 126.204 1.802 . . . . 0.0 111.761 172.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 51.71 23.77 2.13 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 127.747 2.419 . . . . 0.0 113.164 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.8 mm-40 -78.68 -26.45 45.0 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.785 1.234 . . . . 0.0 113.624 -165.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.419 HD11 HD22 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -76.81 145.11 38.67 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 125.473 1.509 . . . . 0.0 109.69 -157.608 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 22.0 t -124.31 158.39 31.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 126.453 1.901 . . . . 0.0 108.612 -179.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -124.14 143.11 50.67 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 127.055 2.142 . . . . 0.0 106.571 165.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -149.15 163.97 29.22 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 110.252 -1.139 . . . . 0.0 110.252 169.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 20.1 mm -93.29 144.21 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 105.281 -2.118 . . . . 0.0 105.281 157.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 68' ' ' TYR . 28.1 t -45.18 -68.13 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 C-N-CA 126.454 1.902 . . . . 0.0 112.394 178.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 42.7 mttt 59.76 150.75 0.09 OUTLIER Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 130.342 3.457 . . . . 0.0 113.178 -165.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -77.74 -16.35 14.72 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.172 1.915 . . . . 0.0 113.335 -170.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.2 m -69.25 -3.59 14.4 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.35 -0.844 . . . . 0.0 112.84 175.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -115.55 172.59 7.02 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.574 1.55 . . . . 0.0 108.593 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.9 m -108.9 123.94 49.86 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 -168.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.535 HG11 HG13 ' A' ' 55' ' ' VAL . 0.6 OUTLIER -142.64 155.82 63.36 Favored Pre-proline 0 CA--C 1.534 0.333 0 C-N-CA 124.025 0.93 . . . . 0.0 111.374 -170.283 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.536 ' HG2' HD21 ' A' ' 103' ' ' LEU . 8.2 Cg_endo -65.93 172.99 7.63 Favored 'Trans proline' 0 CA--C 1.538 0.691 0 C-N-CA 123.563 2.842 . . . . 0.0 111.171 164.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.15 139.81 44.76 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 121.323 -0.861 . . . . 0.0 111.861 -178.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 80.54 54.45 3.72 Favored Glycine 0 CA--C 1.488 -1.638 0 C-N-CA 126.201 1.858 . . . . 0.0 113.848 172.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.805 HG23 ' HB2' ' A' ' 68' ' ' TYR . 1.6 p 176.35 71.92 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 N-CA-C 104.962 -2.236 . . . . 0.0 104.962 -169.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -109.9 -16.12 13.93 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 124.599 1.159 . . . . 0.0 111.27 176.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -145.2 12.71 1.39 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.406 2.282 . . . . 0.0 110.321 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.805 ' HB2' HG23 ' A' ' 65' ' ' VAL . 4.1 m-85 -62.21 147.42 47.89 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 106.669 -1.604 . . . . 0.0 106.669 168.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 50.4 m -71.9 159.94 33.4 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 163.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.6 p90 -140.55 155.84 46.48 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.4 1.08 . . . . 0.0 109.982 165.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -117.9 133.76 55.61 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 106.081 -1.822 . . . . 0.0 106.081 167.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.6 p -149.83 164.94 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.884 1.674 . . . . 0.0 106.783 169.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.432 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -98.31 149.66 22.38 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 119.982 1.264 . . . . 0.0 108.381 171.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.82 -18.69 64.37 Favored 'General case' 0 CA--C 1.529 0.142 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -172.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -136.04 26.43 3.27 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.535 2.334 . . . . 0.0 109.024 -175.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.432 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 25.7 t70 -128.88 39.22 3.83 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 128.138 2.575 . . . . 0.0 105.417 159.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -67.41 -50.3 60.05 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 127.159 2.184 . . . . 0.0 110.778 -161.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -96.84 39.88 1.16 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.539 1.536 . . . . 0.0 107.664 167.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -116.59 -126.08 3.82 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 126.247 1.879 . . . . 0.0 110.146 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.53 136.18 33.05 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 117.427 0.614 . . . . 0.0 109.976 -172.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.1 tt -140.19 151.09 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 CA-C-O 121.585 0.707 . . . . 0.0 109.782 177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.528 HG23 ' HB3' ' A' ' 95' ' ' TYR . 7.8 mt -134.9 108.72 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -77.08 152.98 34.79 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.155 0.889 . . . . 0.0 109.552 167.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.0 p90 -152.86 164.91 36.98 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.313 -1.492 . . . . 0.0 109.825 166.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.0 tttt -148.55 138.04 21.99 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 158.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -74.98 151.24 38.83 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 162.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -138.46 13.54 2.77 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.342 1.857 . . . . 0.0 111.444 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 103.5 100.84 2.61 Favored Glycine 0 C--N 1.339 0.718 0 N-CA-C 108.79 -1.724 . . . . 0.0 108.79 -178.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 49.6 12.92 0.07 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 126.576 1.95 . . . . 0.0 115.097 -171.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.68 148.37 39.0 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 124.892 1.277 . . . . 0.0 107.688 -174.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 60.1 t -135.45 114.72 16.72 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 C-N-CA 125.377 1.471 . . . . 0.0 107.743 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.46 HD12 ' H ' ' A' ' 92' ' ' ILE . 3.9 mp -79.38 101.23 4.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 N-CA-C 106.109 -1.812 . . . . 0.0 106.109 167.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mt -79.65 113.11 18.54 Favored 'Isoleucine or valine' 0 C--O 1.239 0.509 0 N-CA-C 106.082 -1.822 . . . . 0.0 106.082 169.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.437 ' HD2' ' CE2' ' A' ' 68' ' ' TYR . 13.0 mttt -109.76 100.41 9.42 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 -178.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.528 ' HB3' HG23 ' A' ' 82' ' ' ILE . 43.6 p90 -124.7 174.18 8.05 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 121.548 -0.72 . . . . 0.0 110.869 -171.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.425 HG23 ' O ' ' A' ' 98' ' ' GLN . 1.5 t -169.42 164.72 10.64 Favored 'General case' 0 N--CA 1.448 -0.54 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 -173.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -13.38 60.52 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 124.076 0.95 . . . . 0.0 112.896 166.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.425 ' O ' HG23 ' A' ' 96' ' ' THR . 2.1 tt0 -135.56 -170.6 2.64 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 124.12 0.968 . . . . 0.0 110.754 -162.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.52 -70.38 0.8 Allowed 'General case' 0 CA--C 1.503 -0.839 0 C-N-CA 125.48 1.512 . . . . 0.0 109.798 -173.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -77.23 51.31 0.83 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.644 0.778 . . . . 0.0 112.554 178.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 76.1 p -141.81 165.51 27.28 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 119.734 -1.854 . . . . 0.0 111.283 176.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.04 161.55 24.14 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 121.599 -0.688 . . . . 0.0 110.734 174.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.536 HD21 ' HG2' ' A' ' 62' ' ' PRO . 1.2 mm? -114.42 160.43 19.18 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.877 1.271 . . . . 0.0 109.966 -163.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -73.96 177.16 5.82 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.511 0.724 . . . . 0.0 109.217 162.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.02 51.4 1.31 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.304 1.041 . . . . 0.0 112.043 -171.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.571 ' HE3' HD21 ' A' ' 108' ' ' LEU . 31.3 tptt -65.56 120.14 12.37 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 106.314 -1.735 . . . . 0.0 106.314 173.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -122.18 93.12 3.89 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 119.883 1.22 . . . . 0.0 108.361 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.571 HD21 ' HE3' ' A' ' 106' ' ' LYS . 0.0 OUTLIER -95.92 159.75 14.81 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 123.941 0.896 . . . . 0.0 108.722 178.296 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 68.6 p -73.96 155.2 38.89 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 120.07 -0.652 . . . . 0.0 109.625 167.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 28.3 mt -57.57 -39.12 76.02 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 120.361 -1.462 . . . . 0.0 109.405 166.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 t -63.54 -34.12 77.09 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 124.139 0.976 . . . . 0.0 111.195 179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.66 -69.18 0.13 Allowed 'General case' 0 C--N 1.345 0.391 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 168.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -53.66 -35.26 60.83 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 123.255 0.622 . . . . 0.0 112.407 -169.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 7.9 tmtm? -62.28 -58.23 8.49 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 118.082 0.401 . . . . 0.0 110.695 173.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -66.87 -30.48 70.66 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.703 -170.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.3 -85.36 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.809 2.444 . . . . 0.0 108.023 170.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -90.03 -16.02 30.62 Favored 'General case' 0 N--CA 1.461 0.107 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -161.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -115.06 45.39 1.63 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.146 0.979 . . . . 0.0 110.156 -167.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.72 -37.48 27.24 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.107 1.521 . . . . 0.0 115.107 -164.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . 0.314 0.1 OUTLIER -101.17 -164.42 1.11 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 124.375 1.07 . . . . 0.0 109.968 -173.195 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.92 -22.47 16.3 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.959 1.704 . . . . 0.0 111.971 162.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 35.7 p -80.42 -31.17 37.67 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 117.619 -1.182 . . . . 0.0 110.841 -173.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -61.44 -30.09 70.36 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 120.397 1.453 . . . . 0.0 110.771 177.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 12.2 mtpt -52.8 -34.81 55.33 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 118.838 -0.601 . . . . 0.0 109.731 -178.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.47 -26.33 65.16 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 118.119 -0.943 . . . . 0.0 112.806 -178.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -99.86 -51.61 3.67 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 118.495 0.589 . . . . 0.0 110.065 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 39.3 t -59.26 -48.44 86.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 O-C-N 121.703 -0.623 . . . . 0.0 110.368 -174.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -61.98 -36.96 83.05 Favored 'General case' 0 C--O 1.231 0.11 0 O-C-N 121.81 -0.556 . . . . 0.0 111.794 175.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -62.32 -42.8 99.68 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.223 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 13.2 m-30 -58.91 -39.35 81.28 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.211 1.005 . . . . 0.0 110.306 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.405 HG22 HG21 ' A' ' 30' ' ' VAL . 97.8 t -68.95 -33.08 57.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 O-C-N 121.694 -0.629 . . . . 0.0 111.236 179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -86.38 -16.28 37.8 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.128 0.877 . . . . 0.0 111.712 174.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.39 -46.29 6.56 Favored Glycine 0 CA--C 1.52 0.364 0 C-N-CA 125.72 1.629 . . . . 0.0 110.787 -178.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.1 pp -55.29 142.44 31.84 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-O 121.45 0.643 . . . . 0.0 109.805 176.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.26 171.68 11.73 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.801 1.641 . . . . 0.0 110.103 172.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.76 -5.48 11.57 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.876 0.87 . . . . 0.0 111.782 171.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 . . . . . 0 C--O 1.24 0.567 0 C-N-CA 130.919 3.688 . . . . 0.0 107.098 175.435 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.049 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -138.74 125.93 21.46 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 175.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 44.37 56.7 4.8 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.04 1.736 . . . . 0.0 112.372 -176.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -152.81 121.07 6.25 Favored 'General case' 0 C--N 1.338 0.097 0 O-C-N 120.933 -1.104 . . . . 0.0 109.733 177.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 65.57 -173.56 0.18 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 127.938 2.495 . . . . 0.0 110.089 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.8 p -126.53 149.27 49.48 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.251 1.42 . . . . 0.0 107.666 164.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -66.11 -23.89 66.59 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.602 1.161 . . . . 0.0 111.424 -169.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -56.65 -48.88 76.58 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.284 2.233 . . . . 0.0 109.798 170.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -67.72 -36.02 79.84 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.726 1.61 . . . . 0.0 110.742 -179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 97.6 mt -69.8 -42.84 80.14 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 C-N-CA 123.975 0.91 . . . . 0.0 111.037 -172.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -65.06 -29.93 76.65 Favored Glycine 0 C--N 1.334 0.447 0 CA-C-N 119.062 0.847 . . . . 0.0 112.152 -175.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 78.6 t -62.65 -56.73 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 171.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.4 mp -56.58 -40.36 75.11 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.706 0.802 . . . . 0.0 112.169 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -69.84 -44.54 69.69 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 118.9 0.773 . . . . 0.0 111.069 178.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.05 -21.88 79.5 Favored Glycine 0 CA--C 1.533 1.168 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.4 mp -66.06 -22.45 66.42 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 120.268 -1.725 . . . . 0.0 112.116 170.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.85 -18.43 32.88 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 118.103 -0.951 . . . . 0.0 113.078 173.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -132.71 94.99 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -176.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 59.33 70.52 1.09 Allowed Pre-proline 0 CA--C 1.541 0.62 0 C-N-CA 126.698 1.999 . . . . 0.0 111.741 -174.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_endo -56.94 -45.42 36.35 Favored 'Trans proline' 0 C--N 1.351 0.672 0 C-N-CA 122.206 1.937 . . . . 0.0 110.584 173.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -56.43 -46.21 80.37 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.63 0.772 . . . . 0.0 112.091 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -57.18 -49.33 76.31 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 119.04 0.836 . . . . 0.0 109.559 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.0 tt -55.15 -58.2 8.65 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 177.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.8 mtpt -55.48 -39.97 71.09 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.544 1.138 . . . . 0.0 110.97 -174.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -67.6 -48.33 67.11 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 118.317 0.508 . . . . 0.0 111.019 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 41.5 m-80 -66.26 -29.24 69.44 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.818 -176.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 40.4 mm -64.61 -45.39 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-N 119.706 1.139 . . . . 0.0 109.764 169.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.83 -10.06 34.53 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 120.972 -1.08 . . . . 0.0 112.759 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -101.86 -4.7 25.83 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.334 1.453 . . . . 0.0 112.991 171.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 46.1 39.8 6.36 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.329 1.452 . . . . 0.0 110.496 -167.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.68 -13.44 15.57 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 125.303 1.441 . . . . 0.0 112.373 -177.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.8 134.52 34.31 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.036 0.934 . . . . 0.0 108.93 -167.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 60.6 t -117.23 164.79 13.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 125.704 1.602 . . . . 0.0 109.232 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -144.21 110.56 5.51 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 129.698 3.199 . . . . 0.0 103.214 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.51 170.8 24.6 Favored Glycine 0 CA--C 1.518 0.253 0 N-CA-C 110.478 -1.049 . . . . 0.0 110.478 170.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 42.2 mm -99.96 143.53 13.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 -175.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.594 HG13 HG11 ' A' ' 61' ' ' VAL . 24.9 t -51.18 -60.43 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 C-N-CA 124.98 1.312 . . . . 0.0 111.538 174.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.5 mttt 60.14 165.69 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.43 0 C-N-CA 125.361 1.464 . . . . 0.0 113.909 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -63.92 -25.83 67.02 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 121.865 1.71 . . . . 0.0 112.743 170.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 30.4 m -86.75 2.7 47.85 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -164.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -125.14 160.78 28.33 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 119.69 1.132 . . . . 0.0 110.548 -170.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.0 m -89.3 114.89 26.33 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.655 0.782 . . . . 0.0 109.101 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.594 HG11 HG13 ' A' ' 55' ' ' VAL . 6.0 m -143.04 165.24 27.16 Favored Pre-proline 0 C--O 1.237 0.436 0 O-C-N 121.369 -0.832 . . . . 0.0 112.428 -170.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.42 ' CG ' HD21 ' A' ' 103' ' ' LEU . 34.6 Cg_endo -66.89 165.0 27.49 Favored 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.136 2.557 . . . . 0.0 111.495 168.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.49 137.92 54.81 Favored 'General case' 0 C--O 1.237 0.418 0 O-C-N 121.835 -0.54 . . . . 0.0 110.562 174.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 97.0 25.22 11.55 Favored Glycine 0 CA--C 1.524 0.626 0 CA-C-O 118.756 -1.024 . . . . 0.0 114.783 161.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.6 m -136.54 29.58 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 124.515 1.126 . . . . 0.0 110.883 -174.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -58.16 -16.27 12.83 Favored 'General case' 0 N--CA 1.484 1.247 0 N-CA-C 117.584 2.439 . . . . 0.0 117.584 -153.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -156.2 32.56 0.33 Allowed 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 127.465 2.306 . . . . 0.0 108.985 172.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -69.4 155.91 39.68 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 167.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.67 153.8 36.94 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 161.058 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 33.5 p90 -136.81 149.49 47.78 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.724 0.809 . . . . 0.0 109.828 164.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.91 127.17 54.78 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 106.276 -1.75 . . . . 0.0 106.276 175.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -145.56 159.6 12.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 171.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.537 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -85.84 159.43 19.71 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 169.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.86 -18.78 57.98 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 112.79 0.663 . . . . 0.0 112.79 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -122.95 7.69 9.29 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.75 1.62 . . . . 0.0 112.539 -173.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.537 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 14.2 t70 -110.38 21.18 16.98 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.0 0.92 . . . . 0.0 111.16 -174.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -49.08 -44.32 41.88 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 128.054 2.542 . . . . 0.0 113.096 -167.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -103.57 -8.81 19.75 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.967 0.907 . . . . 0.0 111.948 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.3 -69.36 1.4 Allowed Glycine 0 C--N 1.334 0.467 0 C-N-CA 125.73 1.633 . . . . 0.0 110.36 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.59 161.83 36.96 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 117.895 0.847 . . . . 0.0 110.815 -170.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tt -163.18 152.23 3.17 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 171.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.7 mt -133.36 143.67 38.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 105.986 -1.857 . . . . 0.0 105.986 168.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 85.4 m-85 -118.5 149.91 40.5 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.826 1.651 . . . . 0.0 108.194 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -147.35 159.99 43.04 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 120.047 1.294 . . . . 0.0 111.87 171.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.0 tttm -154.85 110.59 3.14 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.173 0.589 . . . . 0.0 110.692 167.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.42 108.73 2.06 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 127.992 2.517 . . . . 0.0 112.87 172.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -121.45 97.58 5.57 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.726 1.21 . . . . 0.0 111.345 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 48.92 77.43 0.12 Allowed Glycine 0 CA--C 1.522 0.509 0 C-N-CA 124.317 0.961 . . . . 0.0 113.199 174.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 68.43 -86.56 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.503 1.921 . . . . 0.0 107.906 -155.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.2 m -64.11 131.63 48.08 Favored 'General case' 0 C--N 1.314 -0.962 0 C-N-CA 125.043 1.337 . . . . 0.0 113.769 -157.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.414 ' O ' ' HA ' ' A' ' 107' ' ' ALA . 2.8 m -101.05 114.6 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.977 0 O-C-N 121.089 -1.007 . . . . 0.0 111.424 -179.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.504 HD12 ' H ' ' A' ' 92' ' ' ILE . 4.3 mp -72.6 100.59 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 106.889 -1.523 . . . . 0.0 106.889 172.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.413 ' CD1' HD23 ' A' ' 108' ' ' LEU . 16.8 mt -81.08 139.76 17.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 105.987 -1.857 . . . . 0.0 105.987 167.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -129.7 112.53 13.74 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 125.273 1.429 . . . . 0.0 107.484 177.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.3 p90 -137.55 167.43 21.68 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 120.854 -1.154 . . . . 0.0 110.533 -168.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -153.48 170.86 19.71 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.681 0.753 . . . . 0.0 109.258 -173.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.88 0.6 13.8 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.257 1.023 . . . . 0.0 110.827 169.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -143.87 153.45 42.35 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 124.108 0.963 . . . . 0.0 111.557 168.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -77.78 1.96 18.58 Favored 'General case' 0 CA--C 1.538 0.511 0 O-C-N 121.421 -0.8 . . . . 0.0 112.409 179.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.58 1.45 14.27 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 115.038 1.495 . . . . 0.0 115.038 -174.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 25.6 p -120.04 173.09 7.29 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.722 0.809 . . . . 0.0 112.544 -165.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 23.7 tptt -71.26 132.1 44.45 Favored 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.597 0.759 . . . . 0.0 109.924 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.443 ' H ' HD22 ' A' ' 103' ' ' LEU . 1.9 mm? -64.18 132.29 49.96 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-O 121.243 0.544 . . . . 0.0 109.562 170.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -67.1 175.43 2.59 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 125.358 1.463 . . . . 0.0 109.425 164.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -124.48 153.07 42.56 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.895 1.278 . . . . 0.0 110.007 176.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.459 ' CD ' HD21 ' A' ' 108' ' ' LEU . 0.4 OUTLIER -165.3 109.63 0.87 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 127.567 2.347 . . . . 0.0 104.773 168.021 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.414 ' HA ' ' O ' ' A' ' 91' ' ' VAL . . . -97.05 121.5 39.01 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 115.412 -2.232 . . . . 0.0 108.073 -171.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.459 HD21 ' CD ' ' A' ' 106' ' ' LYS . 3.4 mm? -119.64 121.97 40.48 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 122.869 2.577 . . . . 0.0 110.782 -171.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.9 p -59.17 143.97 47.3 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-O 121.299 0.571 . . . . 0.0 109.946 176.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 29.3 mt -52.31 -31.58 33.69 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.612 -1.305 . . . . 0.0 112.166 171.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 1.1 t -64.05 -43.36 95.72 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 117.169 -1.396 . . . . 0.0 111.819 174.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -51.88 -65.58 0.53 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-N 119.57 1.077 . . . . 0.0 109.512 173.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -56.9 -34.23 67.7 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 118.354 0.525 . . . . 0.0 111.647 -169.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 ttmp? -70.71 -40.16 73.0 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 118.689 -0.672 . . . . 0.0 110.53 -177.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.38 -59.15 3.95 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 173.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -47.46 -50.81 22.09 Favored 'General case' 0 N--CA 1.454 -0.252 0 O-C-N 124.184 0.928 . . . . 0.0 111.978 -173.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -130.55 14.65 5.47 Favored 'General case' 0 C--O 1.226 -0.182 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 -165.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -149.69 22.83 0.9 Allowed 'General case' 0 C--O 1.239 0.54 0 O-C-N 120.521 -1.362 . . . . 0.0 113.157 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.416 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -55.51 -29.04 58.13 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.094 1.758 . . . . 0.0 113.846 -176.662 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.417 HG23 ' H ' ' A' ' 123' ' ' GLN . 9.6 t -135.7 159.9 40.19 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.069 1.348 . . . . 0.0 111.052 -169.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.0 mtt180 -71.08 -33.02 69.81 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-O 118.533 -0.746 . . . . 0.0 111.867 176.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.57 -37.83 88.8 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 119.686 1.13 . . . . 0.0 109.918 -176.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.417 ' H ' HG23 ' A' ' 120' ' ' THR . 10.3 tt0 -63.27 -19.27 64.42 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.661 1.185 . . . . 0.0 112.955 175.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 81.9 mttt -55.72 -32.91 63.76 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 117.836 -1.078 . . . . 0.0 111.298 174.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -54.21 -59.19 5.0 Favored 'General case' 0 CA--C 1.517 -0.289 0 O-C-N 124.039 0.837 . . . . 0.0 110.469 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -74.07 -47.04 39.29 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 123.35 0.66 . . . . 0.0 110.455 -168.211 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 58.1 t -56.4 -56.53 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -59.35 -31.09 68.88 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 118.529 -0.748 . . . . 0.0 113.014 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -67.68 -37.57 82.51 Favored 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 119.064 0.847 . . . . 0.0 111.187 177.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -61.64 -42.46 98.93 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.611 0.641 . . . . 0.0 109.595 171.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 15.4 t -63.1 -38.89 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 121.445 -0.784 . . . . 0.0 110.517 178.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -81.14 -18.87 44.9 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.824 0.85 . . . . 0.0 112.535 -176.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -108.27 -5.59 32.31 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 125.531 1.539 . . . . 0.0 114.103 -177.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.6 pp -78.08 146.09 35.42 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 118.764 1.282 . . . . 0.0 108.953 170.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 2.7 mtp-105 -90.38 165.01 14.1 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 124.149 0.98 . . . . 0.0 108.978 178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.0 m -121.69 6.07 9.99 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.696 0.798 . . . . 0.0 111.203 176.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . 0.331 7.8 pt-20 . . . . . 0 C--O 1.247 0.921 0 C-N-CA 129.47 3.108 . . . . 0.0 113.177 -162.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.974 0 N-CA-C 111.89 -0.484 . . . . 0.0 111.89 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -159.58 43.35 0.22 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.553 1.541 . . . . 0.0 109.376 169.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 1.7 tpt -147.98 134.52 19.77 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 120.855 -1.153 . . . . 0.0 107.894 173.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . 0.259 0.0 OUTLIER 53.1 -179.39 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.639 2.376 . . . . 0.0 113.667 -174.404 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -59.65 123.74 17.88 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 168.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.3 p -93.57 165.58 12.67 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 88.4 m-20 -56.36 -44.26 79.96 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.968 0.804 . . . . 0.0 110.211 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.36 -50.64 72.32 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.57 0.748 . . . . 0.0 110.03 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -59.01 -48.38 81.8 Favored 'General case' 0 C--O 1.234 0.255 0 C-N-CA 124.564 1.145 . . . . 0.0 109.708 -175.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.2 mt -65.5 -35.91 76.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -175.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -57.83 -36.6 80.62 Favored Glycine 0 C--N 1.338 0.654 0 CA-C-O 118.967 -0.907 . . . . 0.0 112.712 177.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 75.6 t -70.13 -46.45 72.39 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-N 118.176 0.988 . . . . 0.0 109.157 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 113' ' ' LEU . 3.1 mp -60.15 -46.31 90.09 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 124.398 1.079 . . . . 0.0 111.508 177.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -51.99 -48.66 64.31 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.676 1.19 . . . . 0.0 110.515 175.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -64.07 -30.36 77.53 Favored Glycine 0 C--N 1.337 0.623 0 CA-C-O 119.15 -0.806 . . . . 0.0 113.619 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 34' ' ' LEU . 68.3 mt -63.77 -22.59 66.98 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 119.698 1.749 . . . . 0.0 112.408 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.447 ' HB2' ' CE2' ' A' ' 117' ' ' PHE . . . -94.56 -16.39 23.3 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 118.526 -0.75 . . . . 0.0 112.272 174.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.0 mp -126.59 94.64 2.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 60.0 65.88 2.22 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 125.417 1.487 . . . . 0.0 111.865 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.38 -44.17 48.65 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.067 2.511 . . . . 0.0 111.891 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -66.9 -38.74 86.81 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.971 0.908 . . . . 0.0 110.251 -173.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 75.7 t90 -55.66 -56.31 21.94 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.7 tt -54.86 -52.3 63.22 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 121.867 -0.52 . . . . 0.0 110.785 -178.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.7 mttm -56.24 -47.7 77.96 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.655 0.782 . . . . 0.0 111.65 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -66.07 -38.48 88.4 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 118.937 0.79 . . . . 0.0 110.15 -177.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -69.12 -42.04 76.58 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 118.648 0.658 . . . . 0.0 110.62 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 25.4 mm -57.62 -40.29 74.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 119.203 0.911 . . . . 0.0 110.645 177.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.86 -20.08 55.02 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -175.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -119.96 23.25 11.13 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 120.949 -1.095 . . . . 0.0 112.117 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 7.4 t30 45.18 35.41 1.7 Allowed 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.967 2.107 . . . . 0.0 110.748 -176.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -79.52 -12.66 59.86 Favored 'General case' 0 C--O 1.218 -0.594 0 O-C-N 121.28 -0.887 . . . . 0.0 109.799 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -107.77 123.55 48.73 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 119.144 0.884 . . . . 0.0 108.863 -156.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.478 HG12 HG13 ' A' ' 72' ' ' VAL . 3.5 p -111.11 142.98 21.9 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.732 0 C-N-CA 124.565 1.146 . . . . 0.0 109.427 -178.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -99.0 137.78 37.04 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 126.065 1.746 . . . . 0.0 106.703 163.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -154.06 178.64 30.83 Favored Glycine 0 CA--C 1.522 0.494 0 CA-C-N 119.349 0.977 . . . . 0.0 110.944 176.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 18.4 mm -115.07 146.59 19.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 125.557 1.543 . . . . 0.0 107.371 172.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.456 HG13 HG11 ' A' ' 61' ' ' VAL . 32.2 t -54.11 -75.49 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.253 1.273 0 C-N-CA 126.067 1.747 . . . . 0.0 110.935 171.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 5.7 mmtp 54.33 158.23 0.06 OUTLIER Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 129.291 3.036 . . . . 0.0 112.06 -156.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -70.87 -4.9 15.7 Favored 'Trans proline' 0 CA--C 1.536 0.624 0 C-N-CA 122.334 2.023 . . . . 0.0 111.526 167.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.4 m -67.98 3.55 1.52 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 126.53 1.932 . . . . 0.0 113.409 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.5 t0 -136.32 173.55 11.59 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 120.271 1.396 . . . . 0.0 110.668 -173.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 m -90.11 104.12 16.73 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 126.255 1.822 . . . . 0.0 108.118 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.456 HG11 HG13 ' A' ' 55' ' ' VAL . 4.0 m -150.44 154.39 35.66 Favored Pre-proline 0 C--O 1.238 0.488 0 O-C-N 121.894 -0.504 . . . . 0.0 111.625 -168.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.21 166.42 26.96 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.684 2.256 . . . . 0.0 110.954 175.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -76.79 146.93 37.55 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.477 0.711 . . . . 0.0 110.482 -174.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 78.01 32.53 44.16 Favored Glycine 0 CA--C 1.528 0.858 0 O-C-N 121.693 -0.629 . . . . 0.0 113.976 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.9 m -133.63 26.12 1.15 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-N 118.787 1.294 . . . . 0.0 109.806 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -61.05 -16.16 40.54 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 116.478 2.029 . . . . 0.0 116.478 -154.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -143.81 14.88 1.74 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 127.337 2.255 . . . . 0.0 111.516 177.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -66.27 146.29 54.78 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 175.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -73.52 161.98 29.76 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.159 163.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 21.4 p90 -135.55 172.25 13.28 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 125.23 1.412 . . . . 0.0 109.604 165.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 11.9 mt -130.91 135.84 48.04 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 106.181 -1.785 . . . . 0.0 106.181 168.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.478 HG13 HG12 ' A' ' 51' ' ' VAL . 3.7 p -149.19 152.64 11.82 Favored 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-N 120.431 1.469 . . . . 0.0 110.766 -179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.407 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -78.86 112.39 15.98 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 172.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.16 -9.66 18.14 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 129.565 3.146 . . . . 0.0 114.735 177.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -106.55 -39.33 5.89 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 123.478 0.711 . . . . 0.0 109.733 169.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.407 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 7.4 t0 -94.55 51.01 1.38 Allowed 'General case' 0 N--CA 1.442 -0.834 0 N-CA-C 107.402 -1.333 . . . . 0.0 107.402 -171.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -67.82 -2.67 7.63 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -166.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -124.45 14.35 8.86 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 126.194 1.798 . . . . 0.0 111.459 166.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -80.23 -88.09 0.55 Allowed Glycine 0 N--CA 1.448 -0.531 0 O-C-N 120.835 -1.165 . . . . 0.0 111.194 175.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.3 m -130.69 160.86 33.04 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 123.799 0.84 . . . . 0.0 109.291 -170.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.8 tt -154.25 153.79 7.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 169.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.47 HG23 ' HB3' ' A' ' 95' ' ' TYR . 8.7 mt -139.73 112.21 5.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 119.017 0.826 . . . . 0.0 109.503 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -86.34 154.7 21.02 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 119.22 0.918 . . . . 0.0 110.987 177.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.7 p90 -163.06 155.59 18.66 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 123.995 0.918 . . . . 0.0 109.682 172.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.7 tttt -143.25 113.45 7.27 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 123.976 0.91 . . . . 0.0 108.568 167.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -84.81 95.91 9.13 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 176.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -66.01 -2.69 4.27 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.371 0.669 . . . . 0.0 112.385 179.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 91.62 127.64 4.01 Favored Glycine 0 C--N 1.333 0.389 0 N-CA-C 107.45 -2.26 . . . . 0.0 107.45 -178.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.41 ' H ' HD12 ' A' ' 110' ' ' LEU . 90.8 mm-40 52.9 -12.82 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.473 1.909 . . . . 0.0 115.364 -162.048 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 59.9 m -144.37 156.81 44.4 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 122.346 2.339 . . . . 0.0 109.604 175.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.4 ' O ' ' HA ' ' A' ' 107' ' ' ALA . 6.9 p -146.89 106.95 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.507 -0.695 0 C-N-CA 124.892 1.277 . . . . 0.0 111.442 -175.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.9 mp -78.47 108.27 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.769 0 N-CA-C 106.548 -1.649 . . . . 0.0 106.548 176.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 27.0 mt -95.49 126.01 48.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 125.339 1.456 . . . . 0.0 108.258 174.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -123.81 101.73 7.43 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 126.071 1.749 . . . . 0.0 106.709 -173.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.47 ' HB3' HG23 ' A' ' 82' ' ' ILE . 27.6 p90 -116.96 166.49 12.12 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 121.161 -0.962 . . . . 0.0 111.746 -176.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.0 t -147.88 169.08 20.6 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.094 1.358 . . . . 0.0 109.339 173.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.7 p -108.98 -2.67 18.08 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.046 2.539 . . . . 0.0 111.171 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 70.6 mt-30 -135.38 131.8 36.78 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 124.407 1.083 . . . . 0.0 108.871 176.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -23.89 40.48 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 113.215 0.82 . . . . 0.0 113.215 179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -97.78 -0.03 46.03 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 116.354 1.983 . . . . 0.0 116.354 -167.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.7 p -116.48 167.16 11.3 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.851 1.056 . . . . 0.0 113.851 -165.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 5.6 tmtt? -72.5 152.96 41.6 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.486 -0.759 . . . . 0.0 109.408 176.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -87.9 162.75 16.74 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.77 0.828 . . . . 0.0 111.567 -167.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.9 mptt -73.44 -173.85 1.51 Allowed 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.882 1.673 . . . . 0.0 108.989 166.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.0 93.91 2.56 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.081 0.952 . . . . 0.0 111.053 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.565 ' HE3' HD11 ' A' ' 108' ' ' LEU . 29.9 tptt -103.2 150.3 23.82 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 163.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.4 ' HA ' ' O ' ' A' ' 91' ' ' VAL . . . -140.88 125.82 18.23 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 115.708 -2.091 . . . . 0.0 107.159 175.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.565 HD11 ' HE3' ' A' ' 106' ' ' LYS . 1.1 mm? -121.8 158.63 28.44 Favored 'General case' 0 CA--C 1.499 -1.015 0 CA-C-N 122.114 2.233 . . . . 0.0 108.316 -177.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 68.7 p -74.08 156.56 37.31 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 119.891 1.223 . . . . 0.0 109.365 166.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.41 HD12 ' H ' ' A' ' 89' ' ' GLN . 34.5 mt -59.33 -36.1 75.06 Favored 'General case' 0 C--N 1.34 0.154 0 O-C-N 121.441 -0.787 . . . . 0.0 110.079 167.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -66.86 -36.44 82.32 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 117.893 -1.051 . . . . 0.0 110.799 -177.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.31 -59.05 4.64 Favored 'General case' 0 C--N 1.347 0.472 0 C-N-CA 124.062 0.945 . . . . 0.0 109.137 171.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.604 ' HB3' HD23 ' A' ' 31' ' ' LEU . 2.6 mm? -56.14 -40.03 73.17 Favored 'General case' 0 C--N 1.339 0.125 0 C-N-CA 123.09 0.556 . . . . 0.0 112.071 -175.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 5.3 tmtm? -63.58 -45.35 90.81 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 121.784 -0.573 . . . . 0.0 110.009 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.83 -35.06 74.45 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 119.242 -0.409 . . . . 0.0 110.436 -177.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -67.46 -58.84 4.03 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 123.373 0.669 . . . . 0.0 109.241 177.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.447 ' CE2' ' HB2' ' A' ' 35' ' ' ALA . 6.6 m-85 -134.26 19.17 3.7 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -161.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.538 ' HB2' HD21 ' A' ' 31' ' ' LEU . 0.5 OUTLIER -141.01 66.34 1.37 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 120.268 1.395 . . . . 0.0 112.867 171.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -119.32 -25.54 6.07 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 -167.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.2 t -139.66 152.59 46.86 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 120.423 1.465 . . . . 0.0 108.644 -172.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -58.85 -30.51 67.76 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 119.916 -1.74 . . . . 0.0 113.202 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 65.5 m -53.05 -48.3 67.77 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 118.637 -0.697 . . . . 0.0 110.388 179.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.38 -33.03 64.81 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 117.169 -1.812 . . . . 0.0 107.88 -178.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.429 ' HE2' ' HB3' ' A' ' 124' ' ' LYS . 35.2 mtpt -62.94 -3.39 1.6 Allowed 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 114.22 1.193 . . . . 0.0 114.22 174.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? -76.55 -81.89 0.08 Allowed 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 105.35 -2.093 . . . . 0.0 105.35 155.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.64 -49.57 76.04 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -163.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.48 ' HA ' ' CD2' ' A' ' 130' ' ' TYR . 38.3 t -56.86 -38.24 58.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 C-N-CA 125.346 1.458 . . . . 0.0 110.722 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.62 -32.88 47.66 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.396 -0.815 . . . . 0.0 110.871 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -69.15 -31.38 70.0 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 120.899 -1.125 . . . . 0.0 111.461 175.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . 0.48 ' CD2' ' HA ' ' A' ' 127' ' ' VAL . 14.7 m-85 -63.06 -24.68 68.02 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 120.496 -1.378 . . . . 0.0 111.237 172.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 40.3 t -78.19 -11.99 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 C-N-CA 122.942 0.497 . . . . 0.0 110.445 174.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -104.71 -17.01 14.79 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.423 1.089 . . . . 0.0 111.972 172.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -96.91 17.94 58.39 Favored Glycine 0 CA--C 1.527 0.813 0 C-N-CA 125.762 1.648 . . . . 0.0 113.026 179.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.0 pp -106.45 149.08 27.41 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 122.18 0.99 . . . . 0.0 110.275 177.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.409 ' HB3' HG23 ' A' ' 51' ' ' VAL . 5.1 mtt-85 -75.61 169.33 18.32 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.185 2.194 . . . . 0.0 107.83 163.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.22 -3.84 2.42 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.328 1.051 . . . . 0.0 113.014 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 . . . . . 0 C--O 1.245 0.847 0 C-N-CA 131.162 3.785 . . . . 0.0 107.145 177.196 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.602 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 10.4 m80 -77.16 156.02 31.88 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.562 1.181 . . . . 0.0 110.265 174.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 14.2 ptt? -120.46 170.07 9.73 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.908 1.683 . . . . 0.0 110.042 174.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -137.08 140.52 42.04 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 125.079 1.352 . . . . 0.0 108.286 175.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 49.14 -173.05 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.937 1.695 . . . . 0.0 112.126 -165.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -141.2 144.68 34.9 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 129.223 3.009 . . . . 0.0 106.438 174.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -53.01 -43.57 66.6 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 120.174 1.352 . . . . 0.0 110.531 -174.089 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.13 -54.22 7.09 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.065 1.746 . . . . 0.0 110.942 174.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 48.8 mm-40 -68.35 -36.9 79.93 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.675 1.19 . . . . 0.0 111.496 -177.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.402 HD13 ' HB3' ' A' ' 86' ' ' ALA . 97.9 mt -71.8 -39.92 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.066 0 C-N-CA 123.632 0.773 . . . . 0.0 109.39 -173.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -64.13 -35.55 92.13 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-N 118.828 0.74 . . . . 0.0 112.199 -175.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 55.3 t -61.6 -45.33 98.89 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.161 0 CA-C-N 118.303 1.051 . . . . 0.0 109.534 173.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 mp -62.62 -38.47 90.35 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.981 0.912 . . . . 0.0 110.711 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -67.95 -41.03 83.11 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.707 0.803 . . . . 0.0 111.188 176.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.71 -33.44 71.35 Favored Glycine 0 CA--C 1.528 0.87 0 N-CA-C 111.221 -0.751 . . . . 0.0 111.221 176.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.7 mp -63.57 -30.25 71.39 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 120.639 -1.507 . . . . 0.0 111.38 172.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.91 -28.31 64.43 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 117.683 -1.151 . . . . 0.0 112.189 172.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -135.56 96.71 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 C-N-CA 125.375 1.47 . . . . 0.0 107.885 -165.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 60.98 67.41 1.46 Allowed Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.524 1.13 . . . . 0.0 109.762 -177.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_endo -60.29 -33.88 94.18 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.734 2.289 . . . . 0.0 110.866 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -70.37 -39.64 74.48 Favored 'General case' 0 N--CA 1.452 -0.34 0 O-C-N 121.66 -0.65 . . . . 0.0 111.955 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.1 t90 -56.97 -53.23 60.42 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.131 0.878 . . . . 0.0 108.859 174.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -46.4 -57.14 4.93 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.437 1.495 . . . . 0.0 109.329 173.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.1 mtpt -61.68 -41.08 97.08 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.464 1.106 . . . . 0.0 112.27 -175.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -67.55 -48.09 67.97 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.46 1.027 . . . . 0.0 109.562 -179.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -57.32 -42.03 81.05 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.801 0.441 . . . . 0.0 110.2 -179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 16.2 mm -60.52 -54.9 28.74 Favored 'Isoleucine or valine' 0 C--N 1.341 0.236 0 C-N-CA 124.438 1.095 . . . . 0.0 110.132 174.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.75 -42.85 65.33 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.352 0.661 . . . . 0.0 110.691 -175.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -71.23 -8.44 53.61 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 50.34 40.66 23.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.946 1.698 . . . . 0.0 110.979 -165.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 mm-40 -111.64 -5.57 14.48 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 123.871 0.868 . . . . 0.0 113.337 178.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.0 tp -73.63 128.7 36.21 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 119.172 0.896 . . . . 0.0 109.643 179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.8 t -113.54 150.18 15.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 169.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -120.02 149.18 42.58 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 128.067 2.547 . . . . 0.0 106.908 175.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -163.7 177.21 39.64 Favored Glycine 0 N--CA 1.45 -0.413 0 N-CA-C 111.581 -0.607 . . . . 0.0 111.581 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 41.6 mm -106.45 149.24 10.05 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.197 0 C-N-CA 125.375 1.47 . . . . 0.0 107.055 168.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.78 HG13 HG11 ' A' ' 61' ' ' VAL . 24.7 t -52.4 -86.02 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 CA-C-O 116.866 -1.54 . . . . 0.0 110.627 172.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.408 ' N ' HG12 ' A' ' 55' ' ' VAL . 55.3 mmtt 55.44 164.99 0.06 OUTLIER Pre-proline 0 CA--C 1.549 0.925 0 CA-C-N 120.408 1.458 . . . . 0.0 112.956 -167.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -84.12 -3.36 10.29 Favored 'Trans proline' 0 CA--C 1.541 0.831 0 C-N-CA 123.36 2.707 . . . . 0.0 114.632 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.5 m -59.36 -24.16 63.16 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.369 1.068 . . . . 0.0 113.409 -176.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -125.16 165.75 17.68 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 128.982 2.913 . . . . 0.0 108.103 174.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.4 t -65.64 146.69 54.5 Favored 'General case' 0 C--O 1.239 0.54 0 O-C-N 121.781 -0.574 . . . . 0.0 109.568 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.78 HG11 HG13 ' A' ' 55' ' ' VAL . 1.9 m -153.55 162.36 26.82 Favored Pre-proline 0 C--O 1.237 0.413 0 C-N-CA 125.73 1.612 . . . . 0.0 108.865 174.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -75.71 167.82 25.59 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.798 2.332 . . . . 0.0 110.423 171.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -70.68 139.81 51.32 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 123.62 0.768 . . . . 0.0 109.996 171.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 93.54 39.45 5.01 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 125.797 1.665 . . . . 0.0 112.842 169.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.3 m -152.2 27.79 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 125.454 1.501 . . . . 0.0 111.143 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -65.75 -16.19 63.54 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 116.98 2.215 . . . . 0.0 116.98 -151.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 57.5 t0 -153.07 52.06 0.74 Allowed 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 128.547 2.739 . . . . 0.0 106.542 169.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -89.46 154.89 19.68 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 164.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.63 162.14 28.51 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 164.201 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -141.3 170.76 15.12 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.539 1.136 . . . . 0.0 109.757 166.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 18.7 mt -141.22 138.66 33.46 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 126.461 1.904 . . . . 0.0 107.176 174.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.516 HG21 HH21 ' A' ' 99' ' ' ARG . 10.8 p -162.4 155.82 2.65 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 C-N-CA 125.636 1.574 . . . . 0.0 107.571 177.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -77.04 158.18 30.7 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 119.724 1.147 . . . . 0.0 108.97 170.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.26 -21.23 66.11 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 177.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -100.01 -32.01 11.17 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.11 0.964 . . . . 0.0 111.305 176.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.08 13.84 0.19 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.551 2.341 . . . . 0.0 112.076 -178.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 17.9 mm100 -59.5 -12.33 6.13 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.95 1.7 . . . . 0.0 113.793 -171.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -121.59 -2.83 9.36 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.923 0.889 . . . . 0.0 112.119 175.325 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -95.02 -87.92 1.72 Allowed Glycine 0 CA--C 1.526 0.764 0 C-N-CA 124.405 1.002 . . . . 0.0 112.483 -174.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 12.4 m -103.62 166.96 10.1 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.709 1.204 . . . . 0.0 109.298 -174.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.3 tt -166.65 151.24 1.65 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 C-N-CA 124.64 1.176 . . . . 0.0 107.983 165.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.555 HG23 ' HB3' ' A' ' 95' ' ' TYR . 10.9 mt -134.6 99.19 2.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 179.049 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -78.6 153.04 31.46 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -157.9 158.96 36.04 Favored 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.491 -0.755 . . . . 0.0 109.333 167.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.435 ' HA ' ' HE3' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -143.02 106.89 4.66 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 167.805 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.402 ' HB3' HD13 ' A' ' 28' ' ' ILE . . . -82.69 147.61 28.39 Favored 'General case' 0 N--CA 1.457 -0.105 0 N-CA-C 106.355 -1.72 . . . . 0.0 106.355 168.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -147.57 -153.74 0.51 Allowed 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 126.127 1.771 . . . . 0.0 107.911 -167.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -52.93 88.89 0.01 OUTLIER Glycine 0 CA--C 1.527 0.795 0 C-N-CA 125.815 1.674 . . . . 0.0 111.432 172.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 53.88 8.72 0.17 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 127.554 2.342 . . . . 0.0 115.491 178.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.6 m -125.35 163.48 22.49 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.554 1.942 . . . . 0.0 108.124 -175.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 7.7 p -151.19 106.37 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.499 -0.99 0 C-N-CA 125.158 1.383 . . . . 0.0 111.865 174.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.457 HD12 ' H ' ' A' ' 92' ' ' ILE . 3.9 mp -74.41 96.65 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 172.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 15.3 mt -77.8 127.56 38.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 105.991 -1.855 . . . . 0.0 105.991 163.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 41.1 mttt -127.11 97.14 4.83 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 125.389 1.475 . . . . 0.0 107.343 -179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.555 ' HB3' HG23 ' A' ' 82' ' ' ILE . 47.7 p90 -124.03 167.6 13.97 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.018 -1.051 . . . . 0.0 109.69 -173.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . 0.3 9.8 t -131.68 -163.71 1.36 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.83 0.824 . . . . 0.0 109.557 -166.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 p -122.59 -1.63 9.0 Favored 'General case' 0 C--N 1.322 -0.626 0 O-C-N 120.874 -1.141 . . . . 0.0 111.209 152.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -153.48 145.44 23.62 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 124.606 1.163 . . . . 0.0 111.697 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.516 HH21 HG21 ' A' ' 72' ' ' VAL . 11.1 mmt180 -52.13 -33.75 41.35 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 167.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -79.71 -5.22 54.79 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 117.097 2.258 . . . . 0.0 117.097 -173.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 66.7 p -133.11 163.93 28.17 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -168.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.496 ' HD2' ' H ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -69.45 164.02 24.0 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 122.553 1.168 . . . . 0.0 111.452 -164.866 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.496 ' H ' ' HD2' ' A' ' 102' ' ' LYS . 1.3 mm? -94.9 138.3 32.83 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 114.99 -1.005 . . . . 0.0 108.707 -174.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 7.8 mptt -60.38 169.18 1.76 Allowed 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.627 1.171 . . . . 0.0 109.86 161.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -127.07 90.62 3.18 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 124.765 1.226 . . . . 0.0 109.849 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -106.71 83.66 1.88 Allowed 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 105.763 -1.94 . . . . 0.0 105.763 171.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -72.43 138.65 47.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 117.241 -1.361 . . . . 0.0 107.334 168.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 36.0 mt -133.79 -177.45 4.56 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 120.693 1.588 . . . . 0.0 106.795 171.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 62.1 p -101.13 155.73 17.83 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.666 0.746 . . . . 0.0 110.467 172.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 21.7 mt -59.83 -16.67 30.32 Favored 'General case' 0 C--O 1.237 0.435 0 O-C-N 121.641 -0.662 . . . . 0.0 112.238 166.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.16 -50.95 10.18 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-O 117.561 -1.209 . . . . 0.0 109.5 172.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -44.95 -61.27 1.68 Allowed 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 124.403 1.081 . . . . 0.0 109.517 176.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.4 -36.93 74.31 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.214 0.916 . . . . 0.0 112.052 -168.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 50.3 tttm -65.2 -45.01 86.54 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.522 -0.736 . . . . 0.0 110.417 173.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -75.27 -2.01 26.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 126.868 2.067 . . . . 0.0 113.505 177.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -105.95 -46.57 4.07 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.067 1.747 . . . . 0.0 109.69 179.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -139.16 16.9 2.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.373 1.069 . . . . 0.0 113.248 -166.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -139.68 14.86 2.52 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 120.862 -1.149 . . . . 0.0 113.331 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.554 ' NE2' HE22 ' A' ' 123' ' ' GLN . 2.2 pm0 -58.2 -64.15 1.02 Allowed 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 9.6 p -73.37 179.56 3.92 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.914 0.779 . . . . 0.0 111.286 -168.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 36.2 mtt85 -81.51 -55.85 4.41 Favored 'General case' 0 CA--C 1.507 -0.696 0 O-C-N 121.46 -0.775 . . . . 0.0 111.642 170.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 11.5 m -66.13 -26.99 67.7 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.191 -168.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.554 HE22 ' NE2' ' A' ' 119' ' ' GLN . 12.9 tt0 -55.64 -37.77 68.64 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.159 0.584 . . . . 0.0 111.015 173.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.4 mtpt -62.2 -28.43 69.67 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-O 118.157 -0.925 . . . . 0.0 110.71 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.7 ttt180 -63.86 -51.76 63.15 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 -179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -64.89 -57.31 9.15 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 123.6 0.76 . . . . 0.0 110.978 178.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 65.9 t -51.23 -51.14 24.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -177.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -73.78 -24.83 59.89 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.8 0.727 . . . . 0.0 112.555 -176.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -61.04 -48.02 83.67 Favored 'General case' 0 C--N 1.339 0.152 0 C-N-CA 123.926 0.89 . . . . 0.0 109.274 166.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 7.7 m-30 -61.28 -41.02 96.25 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 123.875 0.87 . . . . 0.0 109.719 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 61.0 t -64.17 -22.56 31.38 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 O-C-N 121.14 -0.975 . . . . 0.0 110.837 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -104.08 -13.94 16.09 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 119.842 1.201 . . . . 0.0 113.075 175.302 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.98 -27.17 58.85 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 124.459 1.028 . . . . 0.0 110.686 174.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.5 pp -73.42 147.29 44.37 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 118.3 1.05 . . . . 0.0 110.282 175.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -105.83 167.03 10.06 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 125.474 1.51 . . . . 0.0 107.785 -177.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 7.7 m -126.34 3.06 7.02 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 119.438 1.017 . . . . 0.0 111.431 175.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.149 0 C-N-CA 127.509 2.324 . . . . 0.0 107.181 -178.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.657 0 CA-C-O 119.073 -0.848 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -63.37 98.31 0.16 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.594 1.558 . . . . 0.0 111.725 -169.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 25.2 ttt -155.68 138.19 15.0 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 120.318 1.417 . . . . 0.0 110.496 174.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.9 mtmp? 74.75 101.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 129.209 3.004 . . . . 0.0 108.826 -167.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 56.35 -174.92 0.06 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.765 1.226 . . . . 0.0 109.995 -178.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.0 p -141.52 153.49 44.92 Favored 'General case' 0 N--CA 1.463 0.209 0 O-C-N 120.46 -1.4 . . . . 0.0 111.245 -177.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -61.21 -39.0 88.58 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.494 0.717 . . . . 0.0 110.846 -167.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.02 -49.88 70.68 Favored 'General case' 0 C--N 1.341 0.196 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -177.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 60.9 mm-40 -60.81 -47.44 86.35 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.998 1.319 . . . . 0.0 109.29 -177.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 84.5 mt -61.34 -38.5 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 123.433 0.693 . . . . 0.0 110.242 -179.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -68.64 -19.67 73.26 Favored Glycine 0 CA--C 1.526 0.723 0 CA-C-O 119.136 -0.813 . . . . 0.0 113.636 -178.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 93.9 t -70.53 -52.66 27.24 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.158 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 170.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.83 -36.29 83.44 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 122.297 -0.252 . . . . 0.0 110.755 -176.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.63 -49.67 69.98 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.424 0.69 . . . . 0.0 111.622 171.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.93 -34.3 88.14 Favored Glycine 0 CA--C 1.529 0.935 0 CA-C-O 119.56 -0.578 . . . . 0.0 111.726 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.0 mt -65.19 -27.51 68.74 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.412 1.606 . . . . 0.0 112.041 178.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.36 -14.56 60.08 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.089 -1.007 . . . . 0.0 112.653 172.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.422 HD12 ' CE1' ' A' ' 95' ' ' TYR . 45.2 mm -136.43 89.65 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 C-N-CA 124.947 1.299 . . . . 0.0 107.583 -167.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 64.65 60.49 1.42 Allowed Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 124.652 1.181 . . . . 0.0 110.376 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -58.28 -33.86 98.07 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 123.286 2.658 . . . . 0.0 112.511 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.61 -34.71 78.9 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.083 0.553 . . . . 0.0 111.762 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 46.2 t90 -64.94 -55.92 16.3 Favored 'General case' 0 C--N 1.34 0.155 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 175.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.2 tt -49.15 -50.3 38.29 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.903 0.481 . . . . 0.0 110.055 178.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -55.56 -54.23 46.58 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 124.439 1.096 . . . . 0.0 112.041 177.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -56.82 -42.18 79.14 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.675 0.671 . . . . 0.0 111.689 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -65.02 -53.04 52.3 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 124.334 1.053 . . . . 0.0 109.992 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 mm -58.61 -40.88 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 C-N-CA 124.555 1.142 . . . . 0.0 109.78 -178.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.17 -8.44 17.12 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.648 0.779 . . . . 0.0 112.802 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -121.36 5.86 10.18 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.013 1.725 . . . . 0.0 111.87 175.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 44.95 33.16 0.95 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.516 1.927 . . . . 0.0 111.825 -168.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -98.96 43.48 1.06 Allowed 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 176.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -134.52 142.46 47.02 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 119.572 1.078 . . . . 0.0 108.284 172.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.755 HG23 ' HB3' ' A' ' 135' ' ' ARG . 2.8 p -126.53 165.84 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 C-N-CA 126.651 1.98 . . . . 0.0 110.579 175.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 17.2 t80 -131.62 120.19 22.49 Favored 'General case' 0 N--CA 1.438 -1.064 0 N-CA-C 103.232 -2.877 . . . . 0.0 103.232 175.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -135.46 -178.98 16.11 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 110.273 -1.131 . . . . 0.0 110.273 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 7.0 mm -122.39 144.54 31.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 C-N-CA 125.631 1.572 . . . . 0.0 107.545 172.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 29.7 t -45.85 -75.19 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 C-N-CA 128.481 2.713 . . . . 0.0 111.958 174.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.408 ' HB3' ' HD2' ' A' ' 57' ' ' PRO . 19.4 mmtp 57.3 166.61 0.07 OUTLIER Pre-proline 0 CA--C 1.551 0.985 0 CA-C-N 119.543 1.065 . . . . 0.0 111.326 -166.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 56' ' ' LYS . 96.1 Cg_endo -79.07 -4.06 13.61 Favored 'Trans proline' 0 CA--C 1.538 0.696 0 C-N-CA 122.29 1.993 . . . . 0.0 112.299 -178.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.7 p -58.31 -78.86 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 128.673 2.789 . . . . 0.0 111.808 -171.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -80.47 153.38 28.22 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 108.833 -0.802 . . . . 0.0 108.833 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.31 121.09 16.18 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.051 1.34 . . . . 0.0 109.048 -169.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 5.1 m -135.36 160.92 66.18 Favored Pre-proline 0 C--O 1.24 0.601 0 C-N-CA 123.962 0.905 . . . . 0.0 110.241 -174.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -68.46 171.37 13.1 Favored 'Trans proline' 0 N--CA 1.454 -0.832 0 C-N-CA 122.335 2.023 . . . . 0.0 110.603 170.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -77.37 151.4 34.88 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.425 171.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 75.9 47.82 11.02 Favored Glycine 0 CA--C 1.523 0.554 0 C-N-CA 124.653 1.121 . . . . 0.0 111.122 174.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.6 m -151.4 26.28 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 125.796 1.638 . . . . 0.0 110.15 170.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -61.75 -16.9 53.4 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.577 2.066 . . . . 0.0 116.577 -151.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 53.5 p-10 -144.71 14.34 1.55 Allowed 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 128.082 2.553 . . . . 0.0 111.445 -172.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -70.69 149.47 46.94 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 125.186 1.395 . . . . 0.0 109.666 -179.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.2 m -73.25 164.28 26.9 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.892 163.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 19.9 p90 -142.19 158.36 43.83 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.218 1.007 . . . . 0.0 109.947 166.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -119.71 136.29 54.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 125.577 1.551 . . . . 0.0 107.96 170.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 4.1 p -152.4 155.48 6.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-N 119.454 1.024 . . . . 0.0 109.524 178.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.45 ' HB3' ' HB3' ' A' ' 76' ' ' ASP . . . -90.1 121.77 32.46 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 120.109 1.322 . . . . 0.0 109.186 176.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.43 -10.16 41.17 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.431 1.641 . . . . 0.0 115.431 -166.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -117.39 2.89 12.52 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 124.838 1.255 . . . . 0.0 110.903 -178.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.45 ' HB3' ' HB3' ' A' ' 73' ' ' ALA . 22.5 t0 -135.55 38.53 2.87 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 128.86 2.864 . . . . 0.0 106.902 -179.241 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -64.74 -12.88 51.91 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 120.653 -1.279 . . . . 0.0 113.271 -163.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -107.83 3.81 24.79 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 127.94 2.496 . . . . 0.0 112.346 177.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -81.36 -78.37 0.98 Allowed Glycine 0 C--N 1.336 0.535 0 N-CA-C 110.239 -1.144 . . . . 0.0 110.239 178.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 20.7 m -121.64 156.81 32.21 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.463 1.105 . . . . 0.0 109.817 -174.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.4 tt -152.39 152.88 10.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.525 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 163.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 80.4 mt -133.59 117.79 28.39 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 172.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -84.17 153.87 23.42 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 170.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 21.7 p90 -155.34 162.85 40.73 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 120.924 -1.11 . . . . 0.0 110.265 165.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 30.4 tttt -145.12 129.11 17.48 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 117.971 0.35 . . . . 0.0 111.031 162.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.415 ' HA ' HG22 ' A' ' 91' ' ' VAL . . . -71.32 118.65 14.38 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.707 0.803 . . . . 0.0 109.865 164.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -131.23 76.01 1.69 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 127.752 2.421 . . . . 0.0 106.138 -179.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 89.16 -129.46 9.68 Favored Glycine 0 C--N 1.338 0.686 0 C-N-CA 124.684 1.135 . . . . 0.0 112.142 174.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -88.45 22.29 2.59 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.107 1.453 . . . . 0.0 112.129 170.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 93.9 m -137.16 148.37 46.55 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.945 1.698 . . . . 0.0 108.082 176.068 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.415 HG22 ' HA ' ' A' ' 86' ' ' ALA . 61.5 t -118.76 129.03 75.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 105.2 -2.148 . . . . 0.0 105.2 167.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 19.8 mm -91.39 108.32 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 105.009 -2.219 . . . . 0.0 105.009 169.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.402 HG21 HG13 ' A' ' 36' ' ' ILE . 8.8 mt -89.85 141.96 13.59 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 173.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.445 ' HB3' HD13 ' A' ' 103' ' ' LEU . 68.2 mttt -136.34 100.43 4.38 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 125.473 1.509 . . . . 0.0 108.17 -179.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.422 ' CE1' HD12 ' A' ' 36' ' ' ILE . 34.9 p90 -115.6 165.89 12.52 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 122.75 0.42 . . . . 0.0 111.034 -174.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.505 HG23 ' O ' ' A' ' 98' ' ' GLN . 9.2 t -146.51 171.76 14.58 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 125.801 1.64 . . . . 0.0 107.573 172.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 53.0 p -106.45 19.7 20.11 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.399 1.479 . . . . 0.0 110.253 169.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.505 ' O ' HG23 ' A' ' 96' ' ' THR . 8.0 mm-40 -127.91 -171.46 2.45 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 123.775 0.83 . . . . 0.0 109.217 167.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.71 -25.56 23.4 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 169.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -142.65 15.76 1.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -149.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 77.9 p -119.03 -179.92 3.97 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 119.754 1.161 . . . . 0.0 113.762 -170.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 29.6 tptt -53.22 125.4 17.43 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 123.666 0.786 . . . . 0.0 110.099 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 94' ' ' LYS . 58.6 mt -79.61 159.56 26.74 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 125.59 1.556 . . . . 0.0 109.043 -179.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -82.08 177.4 8.84 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 125.162 1.385 . . . . 0.0 110.162 171.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -118.37 119.76 35.57 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.256 1.422 . . . . 0.0 109.948 171.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 9.3 tptt -144.83 132.62 21.17 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 170.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -138.85 105.45 5.33 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 106.195 -1.779 . . . . 0.0 106.195 -171.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -118.22 145.44 44.99 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -174.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 37.4 p -75.02 153.05 38.66 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.332 0.515 . . . . 0.0 111.917 176.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.3 mt -60.5 -23.94 64.92 Favored 'General case' 0 N--CA 1.464 0.249 0 O-C-N 121.814 -0.554 . . . . 0.0 110.515 168.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.94 -46.41 71.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.321 172.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.7 mm100 -51.41 -65.39 0.56 Allowed 'General case' 0 C--N 1.342 0.247 0 C-N-CA 124.462 1.105 . . . . 0.0 110.304 176.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -59.74 -34.87 73.51 Favored 'General case' 0 CA--C 1.521 -0.137 0 C-N-CA 122.781 0.432 . . . . 0.0 111.878 -170.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.9 ttmp? -69.74 -34.03 73.27 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.906 -0.496 . . . . 0.0 109.834 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -53.92 12.29 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.982 174.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -53.43 -56.74 14.37 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.14 0.976 . . . . 0.0 110.706 -178.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 -124.09 11.62 8.88 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.167 0.987 . . . . 0.0 113.171 -160.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -143.99 23.46 1.7 Allowed 'General case' 0 CA--C 1.537 0.454 0 O-C-N 120.525 -1.359 . . . . 0.0 114.475 175.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.651 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -69.53 -40.29 76.99 Favored 'General case' 0 N--CA 1.465 0.31 0 O-C-N 120.27 -1.519 . . . . 0.0 114.418 -171.445 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 8.8 t -107.05 173.57 6.27 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 126.369 1.868 . . . . 0.0 109.048 -163.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 2.2 mtm-85 -79.65 -47.85 14.71 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 124.104 0.961 . . . . 0.0 112.593 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.0 m -57.42 -37.61 73.03 Favored 'General case' 0 N--CA 1.449 -0.494 0 O-C-N 123.731 0.645 . . . . 0.0 110.519 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.651 HE22 ' NE2' ' A' ' 119' ' ' GLN . 15.1 tt0 -62.33 -29.79 70.7 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.454 -0.779 . . . . 0.0 111.796 179.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 29.4 mtpt -65.68 -33.49 76.01 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 118.047 -0.977 . . . . 0.0 109.801 -178.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -49.38 78.04 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 176.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -69.63 -56.84 6.14 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 118.633 -0.698 . . . . 0.0 110.202 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 53.5 t -49.32 -53.31 9.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 123.882 0.873 . . . . 0.0 110.826 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -71.59 -17.56 62.28 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.731 0.696 . . . . 0.0 112.043 -177.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -80.7 -29.94 36.44 Favored 'General case' 0 N--CA 1.465 0.295 0 O-C-N 121.24 -0.912 . . . . 0.0 111.126 170.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -64.37 -36.64 84.79 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.604 -0.888 . . . . 0.0 108.604 167.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 26.1 t -64.68 -23.47 33.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 O-C-N 121.04 -1.038 . . . . 0.0 110.653 174.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -89.73 15.32 9.87 Favored 'General case' 0 CA--C 1.544 0.717 0 O-C-N 120.782 -1.199 . . . . 0.0 112.25 174.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -136.23 9.31 4.12 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 124.693 1.139 . . . . 0.0 114.258 -174.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -118.2 22.88 11.93 Favored 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -161.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.755 ' HB3' HG23 ' A' ' 51' ' ' VAL . 19.2 mtt180 44.26 -164.04 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 130.675 3.59 . . . . 0.0 110.773 179.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.36 -5.12 0.39 Allowed 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 118.892 -1.123 . . . . 0.0 112.685 159.115 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 . . . . . 0 C--O 1.254 1.322 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 -173.016 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.147 0 N-CA-C 111.785 -0.526 . . . . 0.0 111.785 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 28.8 p-80 -66.98 5.08 0.72 Allowed 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -175.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 6.3 ttp -61.57 -32.44 72.53 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.395 1.878 . . . . 0.0 113.792 -171.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 19.1 tttp 54.77 -162.16 0.14 Allowed 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.109 0.964 . . . . 0.0 112.337 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 46.7 m-85 -103.06 160.68 14.41 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 148.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.0 p -120.26 170.68 9.11 Favored 'General case' 0 N--CA 1.463 0.199 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 165.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -62.65 -43.53 98.58 Favored 'General case' 0 C--O 1.233 0.22 0 O-C-N 121.743 -0.598 . . . . 0.0 110.078 -179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -48.83 80.06 Favored 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 123.987 0.915 . . . . 0.0 109.977 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.8 mm-40 -55.55 -47.36 76.46 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 125.49 1.516 . . . . 0.0 110.391 -175.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.4 mt -64.15 -33.41 62.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -178.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -65.88 -30.84 77.95 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-O 118.957 -0.913 . . . . 0.0 113.871 178.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.446 HG21 HG22 ' A' ' 131' ' ' VAL . 61.6 t -75.89 -44.75 38.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.135 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.3 mp -55.42 -45.46 76.75 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.008 0.523 . . . . 0.0 110.449 173.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.46 -42.46 96.21 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.942 0.497 . . . . 0.0 111.672 177.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -74.33 -20.75 79.55 Favored Glycine 0 CA--C 1.528 0.852 0 N-CA-C 112.115 -0.394 . . . . 0.0 112.115 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.6 mp -69.77 -26.87 64.5 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.985 -1.303 . . . . 0.0 111.803 173.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.428 ' C ' HD12 ' A' ' 36' ' ' ILE . . . -80.88 -27.56 36.26 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 171.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.428 HD12 ' C ' ' A' ' 35' ' ' ALA . 2.3 mp -127.08 95.18 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 -174.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.3 m 67.51 63.5 0.73 Allowed Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.398 1.479 . . . . 0.0 113.009 179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -60.94 -42.4 37.56 Favored 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 123.243 2.628 . . . . 0.0 111.721 176.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.12 -42.71 75.7 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.408 -0.807 . . . . 0.0 110.563 -173.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . 0.463 ' HA ' ' HG2' ' A' ' 43' ' ' GLN . 37.6 t90 -60.04 -37.58 80.21 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.087 0.555 . . . . 0.0 111.604 175.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 tt -60.31 -63.32 1.34 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 172.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -55.13 -36.83 66.17 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 123.585 0.754 . . . . 0.0 112.286 -173.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.463 ' HG2' ' HA ' ' A' ' 40' ' ' TRP 0.252 1.5 pt20 -64.59 -45.15 88.2 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 118.193 0.452 . . . . 0.0 111.166 -176.32 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -69.06 -34.16 74.73 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 124.157 0.983 . . . . 0.0 110.616 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.7 mm -58.87 -45.18 91.82 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.494 166.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.03 -4.3 4.54 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 114.533 1.308 . . . . 0.0 114.533 -177.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -126.57 10.08 7.19 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.276 1.03 . . . . 0.0 111.658 170.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 49.14 31.29 3.42 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.439 2.295 . . . . 0.0 113.111 -173.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.8 mm-40 -91.13 3.37 54.95 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 126.196 1.799 . . . . 0.0 115.657 -174.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.457 HD21 HD22 ' A' ' 71' ' ' LEU . 55.5 tp -87.47 139.53 30.45 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 120.099 1.318 . . . . 0.0 110.758 -177.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 71.8 t -114.33 123.62 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 C-N-CA 124.856 1.263 . . . . 0.0 107.69 165.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -71.93 135.16 46.4 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.269 1.428 . . . . 0.0 107.791 156.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -147.24 167.59 28.44 Favored Glycine 0 C--N 1.333 0.406 0 CA-C-N 118.633 0.652 . . . . 0.0 112.281 175.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 20.0 mm -117.49 134.38 61.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 N-CA-C 106.153 -1.795 . . . . 0.0 106.153 173.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.668 HG13 HG11 ' A' ' 61' ' ' VAL . 28.8 t -47.91 -71.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.454 -0.271 0 C-N-CA 128.194 2.597 . . . . 0.0 110.089 179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 21.2 mttt 58.65 159.03 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.517 0 C-N-CA 127.115 2.166 . . . . 0.0 113.276 -166.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.69 -12.32 30.95 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 121.872 1.715 . . . . 0.0 111.732 179.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 m -60.87 -14.18 20.43 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 125.214 1.405 . . . . 0.0 112.509 175.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -131.38 -173.53 3.14 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 120.237 1.381 . . . . 0.0 112.264 -173.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 24.6 m -129.2 101.69 6.13 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 124.744 1.218 . . . . 0.0 107.803 -149.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.668 HG11 HG13 ' A' ' 55' ' ' VAL . 4.9 m -142.96 157.19 61.49 Favored Pre-proline 0 C--O 1.237 0.431 0 C-N-CA 124.977 1.311 . . . . 0.0 110.859 -154.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -67.24 172.04 10.63 Favored 'Trans proline' 0 N--CA 1.452 -0.964 0 C-N-CA 122.279 1.986 . . . . 0.0 111.573 175.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.52 141.33 57.91 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.775 0.83 . . . . 0.0 111.366 176.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.61 43.16 45.0 Favored Glycine 0 CA--C 1.485 -1.791 0 C-N-CA 124.299 0.952 . . . . 0.0 113.234 176.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.683 HG23 ' HB2' ' A' ' 68' ' ' TYR 0.252 1.6 p -170.37 80.64 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.416 -2.135 0 N-CA-C 105.019 -2.215 . . . . 0.0 105.019 177.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -98.82 -6.64 28.82 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.015 -1.448 . . . . 0.0 112.235 162.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -152.4 -1.64 0.27 Allowed 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 -168.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.683 ' HB2' HG23 ' A' ' 65' ' ' VAL . 3.3 m-85 -67.92 115.66 7.69 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 119.657 1.117 . . . . 0.0 108.343 178.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.8 m -53.8 139.16 33.98 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 124.777 1.231 . . . . 0.0 109.948 -177.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 22.3 p90 -122.38 167.15 13.64 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.353 0.661 . . . . 0.0 112.665 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.457 HD22 HD21 ' A' ' 50' ' ' LEU . 54.0 mt -143.22 125.71 15.77 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 127.336 2.254 . . . . 0.0 106.47 -174.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.6 p -157.39 155.52 4.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 C-N-CA 125.144 1.378 . . . . 0.0 108.397 -178.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -100.87 157.17 16.92 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.416 1.007 . . . . 0.0 110.422 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.01 -25.62 63.82 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 114.544 1.313 . . . . 0.0 114.544 -166.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -106.71 -8.65 16.77 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 124.549 1.14 . . . . 0.0 112.339 -174.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 19.6 p30 -123.48 32.55 5.6 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 123.905 0.882 . . . . 0.0 109.233 -173.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -51.72 -22.42 3.5 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.197 0.999 . . . . 0.0 113.556 173.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -116.47 6.43 13.57 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.77 1.628 . . . . 0.0 112.877 175.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.82 -126.13 1.75 Allowed Glycine 0 CA--C 1.526 0.774 0 C-N-CA 126.39 1.948 . . . . 0.0 110.553 179.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.0 m -64.2 160.1 19.24 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 170.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.2 tt -157.46 147.8 10.24 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 105.517 -2.031 . . . . 0.0 105.517 160.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 88.9 mt -126.99 135.46 63.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 N-CA-C 105.923 -1.88 . . . . 0.0 105.923 175.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -119.61 157.14 29.04 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 126.012 1.725 . . . . 0.0 106.983 176.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.9 p90 -159.72 153.81 23.4 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 120.425 -1.422 . . . . 0.0 108.906 172.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.79 110.68 13.36 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 166.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -71.74 84.32 0.9 Allowed 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 161.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 57.1 mt-10 -75.96 -169.53 1.14 Allowed 'General case' 0 C--O 1.24 0.555 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 169.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -56.62 104.56 0.39 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 124.19 0.9 . . . . 0.0 111.007 178.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.3 mp0 62.55 14.72 7.3 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.323 1.449 . . . . 0.0 111.614 168.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.0 m -144.44 138.96 28.06 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 126.571 1.948 . . . . 0.0 107.985 -172.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 18.5 t -115.38 112.03 38.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 106.727 -1.583 . . . . 0.0 106.727 169.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.429 HD12 ' H ' ' A' ' 92' ' ' ILE . 4.2 mp -86.64 104.12 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 N-CA-C 105.726 -1.953 . . . . 0.0 105.726 166.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 mt -86.54 113.78 24.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.5 0 N-CA-C 106.336 -1.727 . . . . 0.0 106.336 177.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 37.3 mttt -108.4 98.7 8.19 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 126.32 1.848 . . . . 0.0 108.63 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -124.25 165.89 16.85 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 119.925 -1.735 . . . . 0.0 110.533 -175.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.5 t -154.22 171.27 19.47 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 125.635 1.574 . . . . 0.0 108.774 -177.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.5 -11.74 19.07 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.651 1.58 . . . . 0.0 111.288 174.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 66.8 mt-30 -147.6 145.51 29.03 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.15 176.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.0 tpt85 -53.8 -41.35 67.2 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 124.139 0.976 . . . . 0.0 109.796 173.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.407 HD22 ' C ' ' A' ' 100' ' ' ASN . 0.1 OUTLIER -78.56 26.68 0.22 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.489 1.515 . . . . 0.0 114.94 176.382 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.95 158.6 43.9 Favored 'General case' 0 C--O 1.238 0.454 0 O-C-N 119.753 -1.842 . . . . 0.0 112.131 172.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 103' ' ' LEU . 3.4 tptm -63.29 166.68 6.02 Favored 'General case' 0 C--O 1.239 0.552 0 C-N-CA 124.397 1.079 . . . . 0.0 109.616 169.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.416 ' H ' ' HG3' ' A' ' 102' ' ' LYS . 26.5 mt -105.88 156.52 18.27 Favored 'General case' 0 N--CA 1.445 -0.703 0 C-N-CA 125.822 1.649 . . . . 0.0 108.613 -172.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -71.79 -179.28 2.59 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.652 1.181 . . . . 0.0 109.563 165.168 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -142.99 70.84 1.33 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.18 0.992 . . . . 0.0 108.647 167.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 28.0 tptt -70.64 101.14 1.98 Allowed 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 105.728 -1.953 . . . . 0.0 105.728 170.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -95.3 136.29 35.84 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 175.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 29.1 mt -146.89 153.95 40.73 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 126.391 1.876 . . . . 0.0 106.334 -175.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 11.9 p -76.53 154.8 34.25 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.501 -0.749 . . . . 0.0 111.2 176.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 11.8 mt -59.96 -25.52 65.26 Favored 'General case' 0 CA--C 1.533 0.296 0 O-C-N 121.188 -0.945 . . . . 0.0 110.531 169.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.23 -46.29 70.91 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-O 117.264 -1.35 . . . . 0.0 112.607 170.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.95 -60.19 2.4 Favored 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.067 1.347 . . . . 0.0 110.079 177.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.17 -42.22 85.53 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.345 1.458 . . . . 0.0 110.54 -176.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 1.7 tmtt? -66.44 -34.07 77.12 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.471 -0.768 . . . . 0.0 110.257 -178.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.15 -66.58 0.54 Allowed 'General case' 0 N--CA 1.443 -0.823 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 175.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -49.74 -42.15 45.52 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 126.584 1.954 . . . . 0.0 114.333 -166.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -128.1 18.51 6.56 Favored 'General case' 0 C--O 1.226 -0.146 0 CA-C-N 118.181 0.446 . . . . 0.0 111.636 -173.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -142.71 17.17 1.99 Allowed 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.631 -0.668 . . . . 0.0 111.359 177.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.579 ' NE2' HE22 ' A' ' 123' ' ' GLN . 2.6 pm0 -51.05 -74.13 0.03 OUTLIER 'General case' 0 C--N 1.351 0.663 0 CA-C-N 119.313 0.961 . . . . 0.0 111.801 165.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -81.64 151.04 27.8 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 -169.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 62.5 ttt-85 -75.86 -21.43 57.22 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-O 117.702 -1.142 . . . . 0.0 112.382 173.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 1.4 t -59.66 -50.25 74.6 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 119.933 1.242 . . . . 0.0 108.179 175.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.579 HE22 ' NE2' ' A' ' 119' ' ' GLN . 2.9 pt20 -61.65 -24.89 67.02 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.229 0.468 . . . . 0.0 111.917 -177.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 88.6 mttt -69.93 -5.19 24.36 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 118.031 -0.985 . . . . 0.0 112.677 176.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? -70.97 -75.54 0.12 Allowed 'General case' 0 CA--C 1.51 -0.58 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 155.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -55.57 -47.3 76.64 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 114.058 1.133 . . . . 0.0 114.058 -162.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 71.2 t -55.1 -51.36 55.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 C-N-CA 125.091 1.356 . . . . 0.0 110.194 177.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -74.17 -27.42 60.81 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.93 0.892 . . . . 0.0 110.926 -177.155 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -59.61 -51.26 70.56 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.543 2.337 . . . . 0.0 108.542 169.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -57.31 -27.96 62.64 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.577 0.751 . . . . 0.0 111.394 -178.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.446 HG22 HG21 ' A' ' 30' ' ' VAL . 60.2 t -75.36 -25.62 18.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 O-C-N 121.205 -0.935 . . . . 0.0 112.171 177.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -90.8 -18.11 25.46 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.457 -0.777 . . . . 0.0 111.159 173.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.31 9.91 73.4 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.063 1.316 . . . . 0.0 114.658 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.424 ' HB3' HD23 ' A' ' 50' ' ' LEU . 3.8 pp -104.65 167.64 9.6 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.968 1.307 . . . . 0.0 111.667 -178.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 49.8 mtp85 -109.53 176.71 4.98 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 125.47 1.508 . . . . 0.0 108.671 172.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -140.82 3.94 1.87 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.752 0.421 . . . . 0.0 111.216 -169.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 17.7 tt0 . . . . . 0 C--O 1.246 0.915 0 C-N-CA 129.113 2.965 . . . . 0.0 109.839 -158.987 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.806 0 N-CA-C 110.278 -1.129 . . . . 0.0 110.278 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 7.8 m80 55.27 178.23 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 126.176 1.79 . . . . 0.0 113.332 -165.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 43.9 mmm -48.59 103.95 0.05 Allowed 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 126.937 2.095 . . . . 0.0 108.779 169.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 7.5 ttmt -150.59 -172.76 4.27 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 174.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.58 -166.23 2.34 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 171.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.15 137.71 54.84 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.508 1.523 . . . . 0.0 107.956 175.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -69.58 -40.09 76.94 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.757 -0.59 . . . . 0.0 110.282 -166.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.4 HE22 HD11 ' A' ' 134' ' ' LEU . 1.1 mm100 -45.6 -51.05 12.62 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.37 1.468 . . . . 0.0 110.231 165.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.6 mp0 -69.59 -37.39 76.9 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.561 1.144 . . . . 0.0 112.053 -178.023 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 1.7 mt -62.52 -36.49 75.21 Favored 'Isoleucine or valine' 0 C--N 1.342 0.278 0 CA-C-N 120.499 1.5 . . . . 0.0 110.909 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -51.85 -48.13 51.83 Favored Glycine 0 C--N 1.336 0.571 0 CA-C-N 119.65 1.113 . . . . 0.0 112.827 -174.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 98.4 t -62.26 -46.23 96.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-N 117.226 0.513 . . . . 0.0 110.084 -178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.491 HD21 HG11 ' A' ' 127' ' ' VAL . 80.6 mt -70.68 -34.09 71.61 Favored 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 123.327 0.651 . . . . 0.0 111.436 -176.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.26 -48.46 78.08 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.04 0.936 . . . . 0.0 109.631 171.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -58.75 -34.62 78.15 Favored Glycine 0 C--N 1.336 0.578 0 N-CA-C 111.644 -0.582 . . . . 0.0 111.644 175.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.1 mt -63.78 -31.06 72.11 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 120.607 -1.525 . . . . 0.0 110.794 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.14 -19.14 57.27 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 117.592 -1.194 . . . . 0.0 113.252 172.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.0 mm -144.4 93.0 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 125.905 1.682 . . . . 0.0 108.085 -163.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t 56.27 71.66 1.15 Allowed Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 126.5 1.92 . . . . 0.0 111.629 -171.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -60.58 -42.88 36.42 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.447 2.098 . . . . 0.0 109.208 171.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.86 -56.23 13.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.195 1.398 . . . . 0.0 110.99 177.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 69.3 t90 -53.07 -53.21 53.66 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.543 0.61 . . . . 0.0 110.214 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.7 tt -59.1 -48.26 82.26 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 118.438 0.563 . . . . 0.0 110.678 -178.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.0 mttm -56.0 -45.55 79.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 118.679 0.672 . . . . 0.0 110.589 179.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -69.3 -39.57 78.22 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 -175.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -65.27 -46.84 78.85 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.391 -0.818 . . . . 0.0 111.257 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.6 mm -60.87 -35.29 63.71 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.114 0 C-N-CA 123.9 0.88 . . . . 0.0 110.416 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.48 -39.76 58.16 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 119.03 0.832 . . . . 0.0 111.319 -179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -100.98 6.23 43.45 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.013 1.725 . . . . 0.0 113.302 178.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 54.27 19.39 2.19 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.199 1.799 . . . . 0.0 112.147 -171.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -83.25 10.01 9.41 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 119.984 -1.698 . . . . 0.0 112.128 -178.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.4 tp -84.85 145.92 27.58 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 106.464 -1.68 . . . . 0.0 106.464 171.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.579 HG23 ' CB ' ' A' ' 135' ' ' ARG . 3.5 p -128.45 165.52 27.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 125.119 1.368 . . . . 0.0 108.876 167.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -134.11 159.31 41.23 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 128.874 2.87 . . . . 0.0 105.801 177.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.59 175.51 43.98 Favored Glycine 0 CA--C 1.517 0.184 0 N-CA-C 110.851 -0.9 . . . . 0.0 110.851 177.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 42.2 mm -113.8 134.68 55.84 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.715 0 C-N-CA 126.463 1.905 . . . . 0.0 106.589 178.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.525 HG12 HG11 ' A' ' 61' ' ' VAL . 0.4 OUTLIER -44.51 -82.96 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.421 -1.919 1 C-N-CA 132.063 4.145 . . . . 0.0 111.718 169.067 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.515 ' H ' HG23 ' A' ' 55' ' ' VAL . 15.1 mmtt 60.33 166.24 0.09 OUTLIER Pre-proline 0 CA--C 1.536 0.433 0 C-N-CA 124.838 1.255 . . . . 0.0 112.551 -173.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -65.08 -6.91 13.94 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.341 2.027 . . . . 0.0 115.256 167.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.2 m -91.92 -48.52 6.72 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 120.086 1.312 . . . . 0.0 113.872 -166.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.73 169.89 16.41 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.385 0.993 . . . . 0.0 108.972 177.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 18.8 m -80.13 108.52 13.79 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 174.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.525 HG11 HG12 ' A' ' 55' ' ' VAL . 2.6 m -131.89 163.19 51.7 Favored Pre-proline 0 C--O 1.238 0.472 0 C-N-CA 125.292 1.437 . . . . 0.0 108.972 167.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -75.6 164.06 32.91 Favored 'Trans proline' 0 N--CA 1.45 -1.074 0 C-N-CA 121.572 1.515 . . . . 0.0 111.695 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.13 123.43 15.24 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.332 169.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 105.35 26.92 6.03 Favored Glycine 0 CA--C 1.529 0.911 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.026 172.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.1 m -144.21 81.77 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.51 1.524 . . . . 0.0 108.478 172.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -89.85 -14.42 34.39 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 116.15 1.908 . . . . 0.0 116.15 -172.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -165.32 14.9 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 126.863 2.065 . . . . 0.0 110.599 -176.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.426 ' CG ' ' HB2' ' A' ' 85' ' ' LYS . 10.3 m-85 -77.13 110.12 11.55 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 175.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.3 m -49.99 139.05 14.5 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.36 0.664 . . . . 0.0 109.483 168.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 83' ' ' PHE . 36.8 p90 -112.29 170.38 8.21 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 119.099 0.863 . . . . 0.0 110.703 174.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.9 mt -135.3 135.9 41.18 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 127.0 2.12 . . . . 0.0 106.241 169.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.547 ' HB ' HG13 ' A' ' 81' ' ' ILE . 4.1 p -144.41 162.24 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 CA-C-N 119.398 0.999 . . . . 0.0 108.727 175.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -82.67 122.82 28.64 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 172.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.06 -30.76 71.34 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 119.085 0.857 . . . . 0.0 110.906 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.85 -10.13 29.7 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 124.359 1.064 . . . . 0.0 112.236 -176.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.16 53.73 1.96 Allowed 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 176.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -47.72 -46.4 29.63 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.918 -0.489 . . . . 0.0 112.271 178.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -85.75 2.63 44.74 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.937 1.295 . . . . 0.0 111.969 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.5 -69.13 1.36 Allowed Glycine 0 CA--C 1.532 1.097 0 C-N-CA 126.261 1.886 . . . . 0.0 113.893 -165.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.7 m -143.47 158.72 43.42 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.451 1.5 . . . . 0.0 109.206 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.547 HG13 ' HB ' ' A' ' 72' ' ' VAL . 7.3 tt -155.51 155.11 5.97 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 CA-C-N 119.315 0.961 . . . . 0.0 109.118 177.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 67.4 mt -139.02 150.59 23.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 175.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 70' ' ' TYR . 50.3 m-85 -128.86 153.77 47.14 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 126.202 1.801 . . . . 0.0 107.592 171.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -152.03 158.5 43.15 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.819 1.248 . . . . 0.0 109.793 175.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.426 ' HB2' ' CG ' ' A' ' 68' ' ' TYR . 10.3 tttt -155.62 125.53 6.53 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 123.996 0.919 . . . . 0.0 108.898 176.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.2 158.15 32.03 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.141 0.428 . . . . 0.0 110.646 167.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -137.87 -3.65 1.81 Allowed 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 177.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 113.17 81.46 1.07 Allowed Glycine 0 C--N 1.338 0.643 0 N-CA-C 110.722 -0.951 . . . . 0.0 110.722 -177.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 75.44 7.55 3.96 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 128.189 2.596 . . . . 0.0 114.527 -173.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.1 m -141.0 160.49 39.96 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.714 1.605 . . . . 0.0 108.064 174.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 87.9 t -134.23 139.77 47.45 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 C-N-CA 126.324 1.85 . . . . 0.0 106.371 174.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 23.8 mm -103.15 114.82 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 173.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.8 mt -94.12 130.91 42.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 173.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 81.8 mttt -125.02 97.71 5.37 Favored 'General case' 0 C--O 1.222 -0.375 0 C-N-CA 126.994 2.118 . . . . 0.0 107.192 -176.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 25.0 p90 -124.76 169.79 11.66 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.508 -1.37 . . . . 0.0 110.094 -171.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.4 t -154.31 168.36 26.85 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 123.301 0.64 . . . . 0.0 109.498 176.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.0 p -91.1 -10.59 41.44 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.779 1.632 . . . . 0.0 112.244 170.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 -147.17 123.25 10.78 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.385 1.074 . . . . 0.0 110.236 -170.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 -51.99 -36.03 48.46 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 125.113 1.365 . . . . 0.0 111.695 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.03 -3.48 32.75 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 125.947 1.699 . . . . 0.0 114.925 -173.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 68.4 p -119.95 171.92 8.1 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -162.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.05 152.03 41.4 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 121.287 -0.883 . . . . 0.0 109.264 177.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -85.53 135.37 33.85 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 172.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.72 176.12 0.41 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 125.266 1.427 . . . . 0.0 109.391 162.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.28 106.0 4.48 Favored 'General case' 0 C--O 1.232 0.181 0 O-C-N 121.355 -0.84 . . . . 0.0 109.561 -175.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.451 ' HG2' HD21 ' A' ' 108' ' ' LEU . 2.5 tppt? -121.66 108.08 13.13 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 106.363 -1.718 . . . . 0.0 106.363 171.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -81.27 140.74 34.67 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 169.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.451 HD21 ' HG2' ' A' ' 106' ' ' LYS . 3.0 mm? -135.3 135.96 41.23 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 106.819 -1.548 . . . . 0.0 106.819 171.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.37 153.81 33.94 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.718 0.807 . . . . 0.0 109.648 172.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 13.0 mt -55.68 -43.12 76.06 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 120.268 -1.52 . . . . 0.0 108.46 166.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 39.9 t -51.67 -55.09 21.49 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 118.902 -0.57 . . . . 0.0 109.959 177.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -44.53 -66.34 0.4 Allowed 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 127.568 2.347 . . . . 0.0 110.48 175.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 83.4 mt -64.14 -31.65 72.93 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 119.374 -0.346 . . . . 0.0 111.665 -175.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -70.29 -39.71 74.71 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.959 -1.088 . . . . 0.0 108.225 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -51.02 61.16 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-O 117.885 -1.055 . . . . 0.0 108.623 174.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -55.68 -44.81 77.65 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 118.774 0.715 . . . . 0.0 111.705 -174.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -141.85 16.36 2.13 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -157.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 5.0 t80 -148.49 42.01 0.98 Allowed 'General case' 0 C--O 1.238 0.453 0 O-C-N 120.049 -1.657 . . . . 0.0 111.496 175.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.5 -26.47 13.23 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -170.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 41.5 p -92.49 -174.97 3.85 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.167 1.387 . . . . 0.0 109.765 -178.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.29 -46.64 4.96 Favored 'General case' 0 N--CA 1.466 0.332 0 O-C-N 120.545 -1.347 . . . . 0.0 110.768 -176.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 70.4 m -63.0 -31.01 72.05 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 119.133 0.879 . . . . 0.0 111.297 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -62.12 -16.83 55.23 Favored 'General case' 0 N--CA 1.466 0.345 0 O-C-N 120.75 -1.219 . . . . 0.0 112.9 177.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -65.35 -25.07 67.43 Favored 'General case' 0 N--CA 1.462 0.166 0 O-C-N 121.368 -0.832 . . . . 0.0 111.014 172.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 12.7 mtm180 -77.33 -67.67 0.69 Allowed 'General case' 0 CA--C 1.501 -0.93 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 168.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -53.65 -51.76 62.12 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 124.458 1.098 . . . . 0.0 112.57 -157.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.491 HG11 HD21 ' A' ' 31' ' ' LEU . 36.4 t -53.2 -55.48 12.38 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.231 0 C-N-CA 123.997 0.919 . . . . 0.0 109.216 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -67.59 -28.23 67.58 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -176.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -65.35 -38.32 89.75 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 124.553 1.141 . . . . 0.0 109.757 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 9.2 m-30 -62.47 -33.47 74.92 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.695 0.798 . . . . 0.0 111.146 169.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 11.2 t -70.24 -16.08 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 O-C-N 120.569 -1.332 . . . . 0.0 111.242 173.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -107.83 18.01 21.82 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.086 1.355 . . . . 0.0 110.757 173.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -122.39 18.98 8.18 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 125.658 1.599 . . . . 0.0 111.252 175.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.4 HD11 HE22 ' A' ' 26' ' ' GLN . 3.8 pp -125.48 151.23 46.56 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.279 1.032 . . . . 0.0 111.35 -178.025 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.579 ' CB ' HG23 ' A' ' 51' ' ' VAL . 19.1 mtt85 -72.32 178.5 3.9 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 126.98 2.112 . . . . 0.0 108.951 170.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.88 -0.89 2.05 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 113.892 1.071 . . . . 0.0 113.892 -175.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.256 1.417 0 C-N-CA 126.485 1.914 . . . . 0.0 108.138 179.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.125 -0.79 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -134.24 -55.34 0.86 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 125.295 1.438 . . . . 0.0 111.808 -175.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 27.4 ptm -122.6 -22.11 5.5 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.553 0.741 . . . . 0.0 111.983 -174.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.5 mttm -79.54 101.27 8.17 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 168.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 61.39 169.3 0.1 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 126.695 1.998 . . . . 0.0 112.732 -169.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.6 p -129.69 154.59 47.0 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 104.711 -2.329 . . . . 0.0 104.711 162.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.611 ' HA ' HD12 ' A' ' 28' ' ' ILE . 2.9 m-20 -63.75 -32.64 74.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 117.768 0.258 . . . . 0.0 110.406 -170.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.63 -47.71 83.47 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.056 0.943 . . . . 0.0 111.252 175.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 -62.76 -45.8 91.02 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.366 1.066 . . . . 0.0 109.289 -175.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.611 HD12 ' HA ' ' A' ' 25' ' ' ASP . 28.5 mt -61.52 -44.7 99.04 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.13 0 C-N-CA 124.817 1.247 . . . . 0.0 108.342 179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.57 -37.57 56.64 Favored Glycine 0 CA--C 1.523 0.562 0 C-N-CA 124.168 0.89 . . . . 0.0 111.881 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 75.5 t -64.73 -59.77 3.71 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.137 0 CA-C-N 118.47 1.135 . . . . 0.0 109.042 173.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.43 ' CB ' HD22 ' A' ' 113' ' ' LEU . 33.9 mt -58.36 -42.48 87.03 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 119.432 1.014 . . . . 0.0 110.787 -172.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.26 93.59 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.64 1.176 . . . . 0.0 111.45 176.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.82 -25.19 75.85 Favored Glycine 0 CA--C 1.531 1.046 0 CA-C-N 118.164 0.438 . . . . 0.0 112.342 175.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 54.1 mt -69.99 -41.09 74.84 Favored 'General case' 0 C--O 1.231 0.125 0 O-C-N 120.449 -1.618 . . . . 0.0 110.008 173.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.33 -32.13 73.47 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 119.212 -0.423 . . . . 0.0 111.312 173.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.438 HG21 ' CG ' ' A' ' 95' ' ' TYR . 32.1 mm -126.75 97.74 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 125.908 1.683 . . . . 0.0 107.889 -170.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.276 1.0 OUTLIER 65.83 67.67 0.72 Allowed Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.066 1.746 . . . . 0.0 112.559 173.129 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.79 -35.73 9.16 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.261 2.641 . . . . 0.0 113.285 -176.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -58.97 -58.93 6.47 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.275 1.03 . . . . 0.0 110.104 -177.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 48.8 t90 -47.7 -49.7 27.17 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.481 1.512 . . . . 0.0 111.203 175.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.7 tt -58.86 -47.56 84.48 Favored 'General case' 0 C--N 1.34 0.155 0 O-C-N 121.624 -0.672 . . . . 0.0 110.343 179.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -63.24 -38.5 91.4 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 117.841 -1.076 . . . . 0.0 111.606 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -61.44 -40.1 93.23 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-N 119.625 1.102 . . . . 0.0 109.775 176.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -75.24 -45.51 39.73 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 118.352 -0.832 . . . . 0.0 111.16 -175.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.3 mm -60.91 -45.3 98.52 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.123 0 CA-C-N 119.487 1.039 . . . . 0.0 109.627 176.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.29 -39.26 72.41 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.807 0.73 . . . . 0.0 110.306 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -83.93 0.79 46.43 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 44.41 45.54 7.53 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 126.463 1.905 . . . . 0.0 111.003 -168.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.55 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -104.82 -2.31 24.93 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 177.445 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 14.0 tp -85.5 119.17 25.56 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 120.175 1.352 . . . . 0.0 110.638 -171.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 42.9 t -107.4 120.51 58.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 C-N-CA 125.544 1.538 . . . . 0.0 109.034 -178.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -89.94 153.3 20.72 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 128.124 2.57 . . . . 0.0 108.66 165.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -178.94 175.2 47.17 Favored Glycine 0 C--N 1.333 0.369 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 27.7 mm -115.12 136.3 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 124.599 1.159 . . . . 0.0 108.283 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.533 HG13 HG11 ' A' ' 61' ' ' VAL . 27.5 t -53.4 -75.82 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 129.925 3.29 . . . . 0.0 111.349 -175.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.0 mttt 59.27 167.37 0.08 OUTLIER Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 123.984 0.914 . . . . 0.0 112.191 -172.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -64.98 -4.47 8.93 Favored 'Trans proline' 0 CA--C 1.549 1.253 0 CA-C-N 121.104 1.43 . . . . 0.0 112.747 169.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.1 m -81.04 3.94 21.45 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 126.44 1.896 . . . . 0.0 114.989 -168.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.19 -175.42 4.1 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 120.002 1.273 . . . . 0.0 111.335 171.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.458 ' O ' HG13 ' A' ' 61' ' ' VAL . 8.9 t -75.51 143.8 42.32 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 162.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.533 HG11 HG13 ' A' ' 55' ' ' VAL . 0.4 OUTLIER -160.64 157.62 23.87 Favored Pre-proline 0 CA--C 1.542 0.667 0 C-N-CA 124.316 1.046 . . . . 0.0 110.296 165.583 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -74.36 -177.99 3.67 Favored 'Trans proline' 0 CA--C 1.537 0.66 0 C-N-CA 123.891 3.061 . . . . 0.0 111.379 174.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -75.71 137.2 40.47 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 123.639 0.776 . . . . 0.0 112.567 -177.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 64.15 60.75 6.78 Favored Glycine 0 N--CA 1.442 -0.926 0 C-N-CA 125.131 1.348 . . . . 0.0 109.874 173.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -144.16 30.59 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 125.536 1.535 . . . . 0.0 109.785 165.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -55.19 -15.76 2.6 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 117.7 2.481 . . . . 0.0 117.7 -160.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -154.6 26.74 0.45 Allowed 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 125.362 1.465 . . . . 0.0 110.488 171.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -71.96 108.85 5.42 Favored 'General case' 0 CA--C 1.519 -0.234 0 O-C-N 121.321 -0.862 . . . . 0.0 108.742 174.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.4 m -50.24 137.69 17.7 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.235 1.414 . . . . 0.0 109.846 178.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 23.8 p90 -118.97 160.8 21.32 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 118.71 0.686 . . . . 0.0 111.33 -177.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.0 mt -135.82 133.78 38.2 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 127.566 2.346 . . . . 0.0 106.43 176.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.9 p -161.72 167.87 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 N-CA-C 105.161 -2.163 . . . . 0.0 105.161 -169.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.06 -175.93 4.83 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.999 -1.063 . . . . 0.0 108.67 169.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -93.18 -14.46 27.12 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.6 -0.688 . . . . 0.0 112.759 161.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -139.28 22.21 2.57 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.932 0.893 . . . . 0.0 112.166 -161.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -138.17 34.45 2.33 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.8 1.64 . . . . 0.0 107.926 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -60.99 -18.79 59.52 Favored 'General case' 0 N--CA 1.479 1.012 0 O-C-N 119.651 -1.905 . . . . 0.0 113.473 -160.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -98.73 3.47 47.63 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.786 1.634 . . . . 0.0 113.779 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -94.96 -128.84 5.53 Favored Glycine 0 CA--C 1.529 0.944 0 C-N-CA 125.931 1.729 . . . . 0.0 111.679 -171.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 25.4 m -70.75 156.28 39.71 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.595 -0.944 . . . . 0.0 109.069 173.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 8.3 tt -151.03 158.92 4.55 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 164.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 57.9 mt -136.07 143.12 36.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 106.055 -1.831 . . . . 0.0 106.055 174.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -122.21 154.98 36.78 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 172.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 33.8 p90 -156.69 158.82 37.65 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.24 -0.912 . . . . 0.0 108.918 169.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 14.4 tttt -142.19 109.35 5.54 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 160.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.589 ' HB3' HD13 ' A' ' 28' ' ' ILE . . . -82.69 149.93 27.05 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 165.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -141.64 -154.12 0.5 Allowed 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 128.352 2.661 . . . . 0.0 107.144 -171.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -68.97 89.29 0.24 Allowed Glycine 0 C--N 1.333 0.411 0 C-N-CA 125.073 1.32 . . . . 0.0 110.026 -176.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 62.22 11.0 4.13 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.989 2.116 . . . . 0.0 114.149 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -126.89 162.9 24.83 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 120.515 1.507 . . . . 0.0 108.934 174.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 107' ' ' ALA . 8.4 p -146.82 151.86 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.145 0 C-N-CA 124.811 1.245 . . . . 0.0 108.06 168.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.422 HG22 ' HG3' ' A' ' 94' ' ' LYS . 3.4 mp -116.53 109.45 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 N-CA-C 104.961 -2.237 . . . . 0.0 104.961 166.135 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.2 mt -83.04 127.54 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 165.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.422 ' HG3' HG22 ' A' ' 92' ' ' ILE . 75.7 mttt -120.15 105.29 10.84 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 126.417 1.887 . . . . 0.0 109.017 178.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.438 ' CG ' HG21 ' A' ' 36' ' ' ILE . 26.7 p90 -126.02 167.68 14.99 Favored 'General case' 0 N--CA 1.467 0.41 0 O-C-N 120.858 -1.151 . . . . 0.0 110.461 -176.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.5 t -156.79 163.59 39.06 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 125.574 1.55 . . . . 0.0 107.303 178.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 45.5 p -82.21 -17.32 46.54 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 169.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -145.43 133.17 21.08 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 113.152 0.797 . . . . 0.0 113.152 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.94 -41.58 11.76 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 129.38 3.072 . . . . 0.0 111.312 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -81.66 7.16 13.07 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 114.446 1.276 . . . . 0.0 114.446 -175.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.8 p -136.71 132.61 35.11 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 120.018 -1.677 . . . . 0.0 111.914 -169.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.414 ' HD2' ' H ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -53.65 147.27 11.67 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.432 1.093 . . . . 0.0 112.712 -166.034 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.444 ' H ' HD22 ' A' ' 103' ' ' LEU . 1.8 mm? -71.1 163.61 27.24 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.568 1.547 . . . . 0.0 111.79 -172.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 3.3 mptp? -84.17 177.39 8.24 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 127.454 2.302 . . . . 0.0 109.332 167.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -123.95 118.81 27.88 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.221 1.808 . . . . 0.0 107.955 171.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -127.62 126.47 42.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 103.967 -2.605 . . . . 0.0 103.967 164.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.41 ' HA ' ' O ' ' A' ' 91' ' ' VAL . . . -123.86 130.29 52.36 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 120.924 1.693 . . . . 0.0 108.914 179.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 29.2 mt -134.48 155.88 49.59 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 -173.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 13.5 p -87.18 151.0 23.56 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 121.282 1.856 . . . . 0.0 109.107 170.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 16.6 mt -58.66 -40.4 83.38 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-O 121.762 0.791 . . . . 0.0 109.755 -176.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.3 -37.33 82.82 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 124.407 1.083 . . . . 0.0 110.914 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.96 -57.77 11.09 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 125.931 1.692 . . . . 0.0 112.255 173.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.575 HD23 ' OE2' ' A' ' 116' ' ' GLU . 14.7 mt -56.35 -33.01 65.25 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.702 1.137 . . . . 0.0 110.136 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 11.4 ttmt -72.59 12.1 0.53 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.127 1.371 . . . . 0.0 113.713 175.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.26 -35.02 1.04 Allowed 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 125.945 1.698 . . . . 0.0 110.86 -176.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.575 ' OE2' HD23 ' A' ' 113' ' ' LEU . 2.4 pt-20 -61.91 -86.41 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.563 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 154.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.493 ' CD2' ' HB2' ' A' ' 116' ' ' GLU . 98.7 m-85 -90.82 18.57 6.37 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.724 0.773 . . . . 0.0 110.233 -162.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -147.23 100.18 3.24 Favored 'General case' 0 N--CA 1.448 -0.566 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 174.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -132.33 -33.56 1.28 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 5.8 t -130.95 143.31 50.63 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 120.827 1.649 . . . . 0.0 110.441 -168.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -62.14 -36.59 82.26 Favored 'General case' 0 N--CA 1.468 0.459 0 O-C-N 119.756 -1.84 . . . . 0.0 112.334 -171.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 26.9 t -62.52 -20.1 64.28 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 117.23 -1.367 . . . . 0.0 112.934 176.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -66.32 -23.37 66.35 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 121.046 1.748 . . . . 0.0 111.508 179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 38.7 mttt -60.61 -6.35 1.63 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 126.335 1.854 . . . . 0.0 113.342 -175.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 23.4 ptt180 -104.56 -8.82 18.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 122.903 1.335 . . . . 0.0 114.122 -176.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.95 -62.66 1.56 Allowed 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 127.272 2.229 . . . . 0.0 108.916 176.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 40.8 t -57.69 -42.77 82.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 124.409 1.084 . . . . 0.0 111.467 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -76.27 -13.79 60.15 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 171.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -79.47 -41.72 26.87 Favored 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 125.051 1.34 . . . . 0.0 112.849 -179.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -59.02 -29.23 67.11 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 122.912 0.485 . . . . 0.0 110.29 176.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.3 t -67.03 -26.82 37.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 C-N-CA 123.926 0.89 . . . . 0.0 111.437 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -96.96 -16.46 20.62 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.82 0.736 . . . . 0.0 111.849 175.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.43 -7.38 76.13 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 118.705 0.684 . . . . 0.0 112.878 -179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -84.81 176.19 8.67 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.902 1.281 . . . . 0.0 109.757 167.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 5.4 mtt-85 -139.06 165.85 26.05 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 127.101 2.16 . . . . 0.0 108.368 -175.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -128.11 21.52 6.26 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.838 0.855 . . . . 0.0 110.459 178.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 . . . . . 0 C--O 1.251 1.153 0 C-N-CA 129.839 3.256 . . . . 0.0 110.249 -160.288 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.756 0 N-CA-C 110.973 -0.851 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 43.3 m80 -53.73 -72.79 0.05 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.071 0.948 . . . . 0.0 112.157 -174.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 46.7 mtp -81.46 175.92 10.13 Favored 'General case' 0 C--O 1.236 0.386 0 O-C-N 121.744 -0.598 . . . . 0.0 111.358 -174.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.435 ' HA ' ' HE2' ' A' ' 22' ' ' LYS . 1.4 mmpt? -121.53 168.18 12.03 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.171 1.388 . . . . 0.0 108.046 160.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 57.54 -168.61 0.12 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.135 1.374 . . . . 0.0 109.498 -173.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -135.6 146.6 48.11 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 128.075 2.55 . . . . 0.0 106.143 171.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -55.86 -39.89 72.13 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 122.867 0.467 . . . . 0.0 110.45 -171.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -45.48 94.56 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.175 0.898 . . . . 0.0 110.511 -176.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 52.5 mm-40 -61.01 -34.93 75.59 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 124.835 1.254 . . . . 0.0 110.817 177.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 96.6 mt -74.05 -41.14 52.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 C-N-CA 124.517 1.127 . . . . 0.0 109.748 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -56.58 -42.49 90.49 Favored Glycine 0 C--N 1.335 0.486 0 C-N-CA 124.967 1.27 . . . . 0.0 111.797 -175.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.3 t -60.82 -45.45 97.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.345 0 CA-C-N 117.107 0.454 . . . . 0.0 110.742 176.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 46.1 mt -63.61 -45.37 90.61 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.933 0.788 . . . . 0.0 109.593 -179.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -54.54 -47.45 73.16 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.386 1.075 . . . . 0.0 110.251 176.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.41 -22.67 78.81 Favored Glycine 0 CA--C 1.523 0.579 0 O-C-N 121.696 -0.627 . . . . 0.0 112.504 178.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 38' ' ' PRO . 2.1 tp -69.61 -17.79 63.56 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 120.052 1.926 . . . . 0.0 112.207 174.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.438 ' HB2' ' HE2' ' A' ' 117' ' ' PHE . . . -91.26 -20.88 21.43 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 117.012 -1.47 . . . . 0.0 113.083 170.111 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.5 mp -134.28 105.58 6.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 -176.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.287 2.3 p 57.31 62.06 5.9 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 126.665 1.986 . . . . 0.0 112.141 -179.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.421 ' HB3' ' HA ' ' A' ' 34' ' ' LEU . 39.0 Cg_endo -67.41 -42.14 7.82 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 123.914 3.076 . . . . 0.0 111.016 176.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -64.57 -51.38 63.05 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 -172.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 64.8 t90 -45.62 -48.13 14.7 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.873 0.869 . . . . 0.0 111.194 168.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.7 -52.59 63.69 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.648 -1.242 . . . . 0.0 107.648 -175.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -64.38 -32.99 74.82 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.132 0.973 . . . . 0.0 112.321 -175.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -62.42 -52.06 65.05 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 119.887 1.221 . . . . 0.0 108.29 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -66.55 -37.44 84.97 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 117.972 -1.013 . . . . 0.0 111.875 -176.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 31.5 mm -59.19 -51.04 77.26 Favored 'Isoleucine or valine' 0 C--N 1.342 0.26 0 CA-C-N 119.777 1.171 . . . . 0.0 109.441 172.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.38 -38.14 79.74 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.992 0.815 . . . . 0.0 111.068 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -73.07 -8.3 55.12 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.299 1.04 . . . . 0.0 113.134 176.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 48.05 37.47 7.89 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.62 1.568 . . . . 0.0 112.016 -166.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.5 -6.66 21.56 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.456 1.502 . . . . 0.0 112.288 -177.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -89.26 128.85 35.88 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -173.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.6 t -114.31 156.49 15.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 174.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.9 t80 -123.31 145.25 48.87 Favored 'General case' 0 N--CA 1.441 -0.886 0 C-N-CA 127.423 2.289 . . . . 0.0 106.777 176.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -158.01 175.11 35.3 Favored Glycine 0 CA--C 1.523 0.584 0 CA-C-O 121.76 0.644 . . . . 0.0 113.451 -178.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 8.3 mm -123.02 135.92 61.5 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.599 0 CA-C-O 124.808 2.242 . . . . 0.0 107.423 177.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.599 HG12 HG11 ' A' ' 61' ' ' VAL . 0.8 OUTLIER -68.03 -59.18 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.809 0 C-N-CA 131.282 3.833 . . . . 0.0 109.817 -177.346 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 56.52 165.23 0.07 OUTLIER Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 127.681 2.392 . . . . 0.0 113.34 -170.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.25 80.54 1.01 Allowed 'Trans proline' 0 N--CA 1.448 -1.182 0 N-CA-C 107.528 -1.758 . . . . 0.0 107.528 155.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.5 t -159.1 -72.72 0.08 Allowed 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.309 -1.738 . . . . 0.0 106.309 162.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.89 160.84 7.18 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 123.525 0.73 . . . . 0.0 112.611 -164.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 m -66.42 112.03 3.85 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 172.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.599 HG11 HG12 ' A' ' 55' ' ' VAL . 8.5 m -140.0 160.58 59.89 Favored Pre-proline 0 C--O 1.238 0.488 0 N-CA-C 107.561 -1.274 . . . . 0.0 107.561 178.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.28 168.02 18.84 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.37 2.047 . . . . 0.0 110.794 171.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.11 132.86 49.48 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 171.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 99.7 37.32 3.99 Favored Glycine 0 CA--C 1.492 -1.395 0 CA-C-O 118.399 -1.223 . . . . 0.0 114.198 170.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.873 HG23 ' HB2' ' A' ' 68' ' ' TYR 0.296 1.6 p -174.1 56.17 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.163 0 CA-C-O 123.018 1.39 . . . . 0.0 107.701 -168.175 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -86.76 -4.52 59.19 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 125.732 1.613 . . . . 0.0 112.011 177.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -164.51 20.48 0.06 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.031 2.132 . . . . 0.0 110.719 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.873 ' HB2' HG23 ' A' ' 65' ' ' VAL . 4.5 m-85 -83.69 100.18 10.71 Favored 'General case' 0 CA--C 1.52 -0.185 0 C-N-CA 126.128 1.771 . . . . 0.0 109.241 174.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -44.2 139.96 2.36 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 127.096 2.158 . . . . 0.0 111.86 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.408 ' HD2' HG13 ' A' ' 55' ' ' VAL . 47.0 p90 -127.12 166.93 16.72 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.485 1.114 . . . . 0.0 112.731 -175.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 19.1 mt -139.16 124.9 19.59 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 127.387 2.275 . . . . 0.0 106.347 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.4 p -150.59 143.47 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 C-N-CA 126.138 1.775 . . . . 0.0 106.463 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.1 156.15 34.11 Favored 'General case' 0 C--O 1.231 0.121 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 169.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.95 -24.32 62.44 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -174.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -111.46 3.73 18.33 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 126.434 1.894 . . . . 0.0 110.952 -174.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -101.27 19.82 16.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.203 1.801 . . . . 0.0 111.23 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -44.97 -43.34 8.99 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 126.532 1.933 . . . . 0.0 113.693 -169.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -124.99 13.78 8.46 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.662 1.185 . . . . 0.0 111.479 170.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -74.67 -68.65 1.52 Allowed Glycine 0 CA--C 1.522 0.518 0 C-N-CA 126.215 1.864 . . . . 0.0 110.209 173.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 7.4 m -148.91 156.98 43.08 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.861 0.864 . . . . 0.0 108.805 179.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 10.5 tt -155.88 159.79 2.68 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 172.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.595 HG23 ' HB3' ' A' ' 95' ' ' TYR . 9.7 mt -134.93 157.04 40.65 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 166.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.462 ' CD2' HG21 ' A' ' 65' ' ' VAL . 81.1 m-85 -133.13 155.97 48.29 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 128.122 2.569 . . . . 0.0 107.624 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -164.79 160.45 19.62 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.472 -1.393 . . . . 0.0 109.29 175.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.473 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -149.11 127.45 12.19 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 169.78 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.56 117.67 19.96 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 164.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -100.28 22.28 11.77 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.58 1.552 . . . . 0.0 109.703 -178.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 86.58 121.09 1.3 Allowed Glycine 0 C--N 1.34 0.78 0 C-N-CA 125.324 1.44 . . . . 0.0 110.417 -177.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 50.82 1.01 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.656 2.382 . . . . 0.0 116.385 -171.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -151.5 145.27 25.06 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 126.028 1.731 . . . . 0.0 107.112 -162.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 68.0 t -138.4 108.63 4.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 125.119 1.368 . . . . 0.0 108.075 -175.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.415 HD12 ' H ' ' A' ' 92' ' ' ILE . 4.5 mp -77.88 104.62 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 162.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 34.2 mt -76.98 135.15 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 N-CA-C 106.212 -1.773 . . . . 0.0 106.212 165.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -126.74 103.07 7.34 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.628 1.571 . . . . 0.0 109.825 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.595 ' HB3' HG23 ' A' ' 82' ' ' ILE . 40.6 p90 -119.72 165.56 14.36 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.067 -1.646 . . . . 0.0 111.322 -174.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.6 t -156.9 169.97 23.56 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 125.588 1.555 . . . . 0.0 108.019 171.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.1 m -109.86 -9.05 14.81 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.19 1.396 . . . . 0.0 111.114 172.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -136.0 112.82 10.22 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.5 1.52 . . . . 0.0 108.586 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -48.44 -32.89 8.38 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 126.188 1.795 . . . . 0.0 112.583 175.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . 0.296 0.0 OUTLIER -79.29 3.77 17.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.132 1.901 . . . . 0.0 116.132 178.051 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 82.2 p -120.3 165.75 14.44 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 119.078 0.854 . . . . 0.0 111.168 -178.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.2 tmtt? -66.26 158.01 30.07 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.341 0.591 . . . . 0.0 110.247 -174.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 61.2 mt -91.38 142.7 27.4 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.475 0.71 . . . . 0.0 109.457 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.08 173.08 0.87 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.348 0.659 . . . . 0.0 109.533 164.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -137.62 112.66 9.09 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 124.549 1.14 . . . . 0.0 108.199 170.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 38.2 tptt -123.03 97.69 5.55 Favored 'General case' 0 CA--C 1.52 -0.186 0 N-CA-C 105.314 -2.106 . . . . 0.0 105.314 178.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.94 126.57 35.45 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 178.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -123.3 157.94 32.09 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.895 1.278 . . . . 0.0 108.179 174.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.3 158.87 33.24 Favored 'General case' 0 CA--C 1.536 0.417 0 O-C-N 121.346 -0.846 . . . . 0.0 110.145 162.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 17.2 mt -47.13 -54.49 10.41 Favored 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.168 0.987 . . . . 0.0 109.665 162.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.27 -30.84 70.71 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 117.138 -1.41 . . . . 0.0 112.116 -174.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -62.79 -57.83 9.55 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 120.073 1.306 . . . . 0.0 109.867 173.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 92.8 mt -55.64 -32.14 62.92 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.463 0.574 . . . . 0.0 111.376 -178.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.8 tttm -70.64 -47.03 62.11 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 118.677 -0.678 . . . . 0.0 111.635 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.59 -50.83 71.83 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 119.155 0.889 . . . . 0.0 108.773 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -57.36 -62.38 1.81 Allowed 'General case' 0 N--CA 1.444 -0.744 0 C-N-CA 124.882 1.273 . . . . 0.0 109.025 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.438 ' HE2' ' HB2' ' A' ' 35' ' ' ALA . 19.2 m-85 -127.99 13.38 6.77 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 -157.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -143.77 58.03 1.36 Allowed 'General case' 0 C--O 1.24 0.586 0 O-C-N 119.792 -1.818 . . . . 0.0 109.901 173.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.627 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -108.47 -34.69 6.69 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.825 -168.39 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 4.2 t -107.55 148.05 29.75 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 125.297 1.439 . . . . 0.0 110.294 -173.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 -60.82 -28.97 69.2 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.684 -1.26 . . . . 0.0 110.756 175.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -56.97 -39.22 74.18 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 119.589 1.086 . . . . 0.0 111.243 176.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.627 HE22 ' NE2' ' A' ' 119' ' ' GLN . 0.0 OUTLIER -61.95 -18.52 60.64 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 179.611 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -78.32 -2.46 38.2 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 118.252 -0.88 . . . . 0.0 111.659 178.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.87 -79.71 0.2 Allowed 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 153.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -52.11 -61.88 1.99 Allowed 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 114.293 1.22 . . . . 0.0 114.293 -160.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 76.0 t -55.8 -36.94 45.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 CA-C-N 118.534 0.606 . . . . 0.0 110.559 -176.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -77.34 -30.22 53.85 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.999 1.32 . . . . 0.0 111.896 -177.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.41 -49.76 74.2 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 126.009 1.724 . . . . 0.0 109.394 164.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 5.7 m-30 -59.25 -38.77 80.88 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 118.769 0.713 . . . . 0.0 110.543 -176.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 90.1 t -64.3 -33.26 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-N 118.983 0.811 . . . . 0.0 111.08 175.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -86.38 -23.35 26.18 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 118.86 0.755 . . . . 0.0 112.53 -179.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -87.88 -32.19 13.4 Favored Glycine 0 CA--C 1.524 0.625 0 C-N-CA 125.003 1.287 . . . . 0.0 111.825 -176.505 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.3 pp -56.5 125.5 22.35 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 166.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -79.73 167.37 20.72 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 178.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 9.9 m -134.43 6.64 3.55 Favored 'General case' 0 C--N 1.323 -0.559 0 O-C-N 120.353 -1.467 . . . . 0.0 111.398 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.921 0 C-N-CA 127.719 2.408 . . . . 0.0 104.774 163.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.924 0 N-CA-C 111.54 -0.624 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -78.42 -43.91 26.14 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 159.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 17.0 ptm -111.47 175.75 5.3 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 127.16 2.184 . . . . 0.0 109.208 166.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 78.4 mttt -139.08 -166.05 1.96 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.407 1.883 . . . . 0.0 108.135 176.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.442 ' CZ ' ' HE3' ' A' ' 114' ' ' LYS . 4.5 m-85 54.42 -172.8 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.045 1.338 . . . . 0.0 110.983 -173.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.3 p -138.53 150.26 46.19 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.787 2.035 . . . . 0.0 107.326 171.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -59.4 -41.72 90.1 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.423 0.556 . . . . 0.0 110.106 -174.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.61 HE22 HD11 ' A' ' 134' ' ' LEU . 2.5 mm100 -44.44 -56.04 4.57 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.385 1.874 . . . . 0.0 111.433 169.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -69.43 -30.86 68.89 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.904 1.282 . . . . 0.0 112.605 -174.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.491 HG21 ' HB2' ' A' ' 86' ' ' ALA . 48.2 mt -80.2 -34.96 15.29 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 C-N-CA 123.22 0.608 . . . . 0.0 109.821 -179.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.403 ' CA ' ' CZ ' ' A' ' 84' ' ' PHE . . . -55.73 -44.97 86.69 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 124.048 0.832 . . . . 0.0 112.055 -173.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 91.6 t -56.02 -50.49 69.45 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 118.306 1.053 . . . . 0.0 109.321 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 53.4 mt -58.26 -39.31 78.87 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.334 0.97 . . . . 0.0 110.832 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -64.13 -47.35 80.27 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 118.879 -0.581 . . . . 0.0 111.816 176.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.71 -29.27 72.73 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.976 0.807 . . . . 0.0 111.378 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 47.8 mt -62.08 -28.31 69.52 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 120.356 -1.673 . . . . 0.0 110.62 172.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.26 -12.99 59.95 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 117.111 -1.423 . . . . 0.0 113.094 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.0 mm -143.64 98.95 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 C-N-CA 125.799 1.64 . . . . 0.0 107.309 -173.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 1.4 t 56.71 68.65 2.06 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 124.836 1.254 . . . . 0.0 112.083 -175.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -61.32 -37.87 69.44 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 122.328 2.018 . . . . 0.0 110.711 176.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.41 -47.01 77.74 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 118.185 -0.912 . . . . 0.0 112.078 -173.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 59.4 t90 -52.93 -52.94 56.13 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 174.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tt -58.15 -52.0 67.38 Favored 'General case' 0 N--CA 1.456 -0.17 0 O-C-N 121.454 -0.779 . . . . 0.0 110.929 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.4 mttt -57.83 -35.17 70.51 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 118.574 -0.727 . . . . 0.0 111.123 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -69.66 -50.7 41.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 178.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -59.19 -38.41 79.76 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 118.354 -0.831 . . . . 0.0 112.305 -177.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 31.4 mm -60.53 -53.19 52.3 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 119.319 0.963 . . . . 0.0 109.36 173.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.65 -41.2 81.0 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 117.836 0.289 . . . . 0.0 110.749 -179.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -69.53 -17.66 63.6 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 125.505 1.522 . . . . 0.0 113.141 176.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.1 t30 59.02 30.05 19.77 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.641 1.577 . . . . 0.0 110.838 -169.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.405 HE21 ' HA ' ' A' ' 49' ' ' GLN . 4.1 mm-40 -94.22 -16.65 23.46 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.879 1.272 . . . . 0.0 112.703 -177.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.57 135.7 35.57 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 125.439 1.496 . . . . 0.0 109.59 -169.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 45.8 t -122.15 145.69 28.48 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 124.759 1.224 . . . . 0.0 108.004 170.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -106.31 136.22 46.42 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 128.049 2.54 . . . . 0.0 106.683 173.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -153.36 178.65 30.27 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-O 122.9 1.278 . . . . 0.0 113.697 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 26.8 mm -130.49 137.82 55.27 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.932 0 C-N-CA 127.981 2.512 . . . . 0.0 108.14 -171.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.605 HG12 HG11 ' A' ' 61' ' ' VAL 0.255 2.8 m -70.59 -75.34 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.409 -2.503 0 CA-C-N 108.823 -3.808 . . . . 0.0 108.675 179.398 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp 55.39 167.39 0.05 OUTLIER Pre-proline 0 C--N 1.349 0.543 0 C-N-CA 125.301 1.44 . . . . 0.0 111.573 -173.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -66.84 73.18 0.44 Allowed 'Trans proline' 0 CA--C 1.541 0.856 0 C-N-CA 121.719 1.613 . . . . 0.0 110.375 164.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.3 t -153.16 -63.67 0.15 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.826 1.25 . . . . 0.0 112.65 175.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.68 175.73 9.08 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 120.566 1.53 . . . . 0.0 110.935 -172.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.3 t -93.69 121.15 34.83 Favored 'General case' 0 N--CA 1.446 -0.663 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 -179.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.605 HG11 HG12 ' A' ' 55' ' ' VAL . 4.8 m -150.42 160.8 32.28 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 123.957 0.903 . . . . 0.0 109.011 -176.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -71.5 158.92 52.79 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 121.937 1.758 . . . . 0.0 111.092 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.19 129.55 40.62 Favored 'General case' 0 C--O 1.243 0.746 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 173.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 101.64 22.99 9.72 Favored Glycine 0 CA--C 1.534 1.271 0 CA-C-O 117.461 -1.744 . . . . 0.0 114.824 174.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.2 m -141.2 70.01 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 CA-C-N 119.8 1.8 . . . . 0.0 110.1 172.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -85.3 -11.49 54.58 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.923 1.689 . . . . 0.0 114.61 -172.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -170.44 25.68 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 126.266 1.826 . . . . 0.0 109.506 -166.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.431 ' CD1' ' HB2' ' A' ' 85' ' ' LYS . 3.5 m-85 -94.98 105.75 17.69 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 125.687 1.595 . . . . 0.0 107.426 176.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.08 150.11 4.66 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 118.99 0.813 . . . . 0.0 110.69 172.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -130.73 158.46 40.05 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.174 0.59 . . . . 0.0 111.03 -176.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -120.63 128.48 53.05 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 127.096 2.158 . . . . 0.0 106.98 174.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -153.22 159.62 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 173.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.419 ' HB3' ' HB2' ' A' ' 76' ' ' ASP . . . -89.78 161.45 16.02 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.371 0.605 . . . . 0.0 110.407 176.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.8 -5.59 4.5 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.106 0.962 . . . . 0.0 113.52 172.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -140.3 22.63 2.38 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.659 0.784 . . . . 0.0 110.972 -175.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.419 ' HB2' ' HB3' ' A' ' 73' ' ' ALA . 19.7 m-20 -127.0 29.18 5.66 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.407 1.883 . . . . 0.0 109.407 179.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -63.61 -5.33 3.81 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 119.252 -2.155 . . . . 0.0 114.33 -177.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.2 p-10 -143.19 22.49 1.88 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.093 1.357 . . . . 0.0 111.511 160.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -85.12 -71.83 1.31 Allowed Glycine 0 CA--C 1.526 0.755 0 C-N-CA 125.634 1.587 . . . . 0.0 111.198 -176.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 21.4 m -145.29 160.78 40.99 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.206 1.802 . . . . 0.0 107.572 177.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tt -152.4 155.04 7.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 168.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 16.2 mt -130.76 140.52 48.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.126 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 166.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -114.83 146.82 40.64 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.326 1.85 . . . . 0.0 109.2 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . 0.403 ' CZ ' ' CA ' ' A' ' 29' ' ' GLY . 45.1 p90 -151.59 156.74 41.07 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.126 -0.984 . . . . 0.0 110.92 172.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.431 ' HB2' ' CD1' ' A' ' 68' ' ' TYR . 0.0 OUTLIER -148.57 90.29 1.77 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.859 2.064 . . . . 0.0 110.248 178.836 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.491 ' HB2' HG21 ' A' ' 28' ' ' ILE . . . -72.36 104.42 3.74 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 119.287 -0.965 . . . . 0.0 109.006 172.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.14 128.83 55.34 Favored 'General case' 0 N--CA 1.442 -0.85 0 C-N-CA 125.666 1.586 . . . . 0.0 108.265 174.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 57.19 -89.23 0.01 OUTLIER Glycine 0 CA--C 1.528 0.875 0 C-N-CA 125.035 1.302 . . . . 0.0 111.735 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.486 ' HA ' HD12 ' A' ' 110' ' ' LEU . 17.6 mp0 -137.85 17.21 2.86 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.421 2.688 . . . . 0.0 112.024 -174.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 88.6 m -137.29 142.3 41.93 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.981 1.712 . . . . 0.0 110.154 -172.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 3.8 t -128.36 100.72 6.11 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 126.566 1.947 . . . . 0.0 107.04 175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.633 HD12 ' H ' ' A' ' 92' ' ' ILE . 3.3 mp -72.44 77.62 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.736 0 C-N-CA 130.091 3.357 . . . . 0.0 109.198 165.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 3.1 mt -65.14 129.85 29.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 173.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -128.47 121.3 28.61 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.533 1.133 . . . . 0.0 108.073 -176.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 48.8 p90 -145.21 169.54 18.01 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 121.122 -0.986 . . . . 0.0 110.72 -168.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 14.5 t -157.01 174.45 15.5 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.623 0.725 . . . . 0.0 111.29 -171.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.2 p -106.58 -8.99 16.74 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.615 1.166 . . . . 0.0 112.056 165.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -144.42 147.57 33.53 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 123.68 0.792 . . . . 0.0 111.827 -175.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 11.9 ttt-85 -81.57 10.94 5.13 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.582 1.153 . . . . 0.0 112.088 173.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -116.86 3.74 12.91 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 125.418 1.487 . . . . 0.0 114.039 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 34.4 p -130.27 176.1 8.39 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.75 0.82 . . . . 0.0 112.702 -166.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.73 148.56 44.55 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.027 1.331 . . . . 0.0 109.061 172.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 84.9 mt -86.42 142.12 28.65 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 126.434 1.894 . . . . 0.0 108.872 175.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -64.37 168.81 5.28 Favored 'General case' 0 CA--C 1.527 0.07 0 C-N-CA 124.276 1.03 . . . . 0.0 109.841 167.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -129.43 103.72 7.07 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 125.274 1.43 . . . . 0.0 109.55 -179.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.1 tptt -122.29 92.16 3.66 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -82.01 120.25 25.02 Favored 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 171.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.12 145.49 45.91 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 126.737 2.015 . . . . 0.0 106.674 168.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 2.4 p -67.37 157.59 33.69 Favored 'General case' 0 C--O 1.238 0.456 0 O-C-N 121.536 -0.727 . . . . 0.0 111.207 173.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.486 HD12 ' HA ' ' A' ' 89' ' ' GLN . 13.1 mt -51.87 -46.04 64.33 Favored 'General case' 0 C--O 1.234 0.252 0 O-C-N 121.823 -0.548 . . . . 0.0 110.493 166.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.26 -41.01 98.99 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 117.194 -1.384 . . . . 0.0 111.081 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -62.39 1.64 Allowed 'General case' 0 C--N 1.345 0.41 0 CA-C-N 119.402 1.001 . . . . 0.0 109.382 174.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 56.7 mt -60.97 -38.27 85.35 Favored 'General case' 0 N--CA 1.461 0.097 0 N-CA-C 111.945 0.35 . . . . 0.0 111.945 -174.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.442 ' HE3' ' CZ ' ' A' ' 23' ' ' PHE . 1.9 ttmp? -62.99 -43.1 99.72 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 118.849 -0.596 . . . . 0.0 109.77 176.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.77 -56.38 13.94 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.491 1.041 . . . . 0.0 108.354 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -51.69 -42.12 61.94 Favored 'General case' 0 C--O 1.23 0.075 0 C-N-CA 124.929 1.292 . . . . 0.0 111.899 -174.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -132.01 20.39 4.52 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.8 0.44 . . . . 0.0 112.135 -165.351 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -161.99 61.43 0.24 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 122.125 0.964 . . . . 0.0 111.082 176.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.674 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.0 OUTLIER -103.27 -47.85 4.19 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.016 0.926 . . . . 0.0 111.697 179.611 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.525 ' H ' HE21 ' A' ' 123' ' ' GLN . 80.8 p -88.5 161.49 16.96 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 121.246 -0.909 . . . . 0.0 110.137 179.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 63.3 mtt180 -83.06 -32.2 26.94 Favored 'General case' 0 C--N 1.334 -0.104 0 O-C-N 121.807 -0.558 . . . . 0.0 110.599 178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.88 -37.09 80.98 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.981 178.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.674 HE22 ' NE2' ' A' ' 119' ' ' GLN . 2.8 pt20 -65.92 -29.16 69.53 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.972 1.26 . . . . 0.0 111.793 179.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -56.38 -34.34 66.58 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 118.741 -0.647 . . . . 0.0 112.328 -172.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -54.56 -71.14 0.08 Allowed 'General case' 0 C--O 1.215 -0.739 0 C-N-CA 125.566 1.546 . . . . 0.0 108.155 174.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -47.9 -57.81 5.21 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 124.165 0.986 . . . . 0.0 112.585 178.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 92.3 t -55.95 -41.92 69.4 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-O 119.231 -0.414 . . . . 0.0 110.636 -174.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -77.76 -28.68 50.71 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 118.787 0.721 . . . . 0.0 112.091 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 78.6 m-20 -58.91 -44.65 91.32 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 169.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 6.4 m-30 -58.75 -28.48 65.92 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.225 0.61 . . . . 0.0 111.05 179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.71 -14.22 18.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 123.609 0.764 . . . . 0.0 111.628 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -123.0 -12.36 7.98 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 120.174 1.352 . . . . 0.0 112.858 178.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -79.89 -21.08 66.59 Favored Glycine 0 CA--C 1.525 0.665 0 O-C-N 121.466 -0.771 . . . . 0.0 111.269 168.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.61 HD11 HE22 ' A' ' 26' ' ' GLN . 4.4 pp -68.52 141.04 55.65 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 118.369 1.085 . . . . 0.0 108.118 162.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 3.6 mtp180 -88.69 170.26 10.96 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 169.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 8.5 m -130.92 9.26 4.89 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.821 -1.175 . . . . 0.0 110.215 172.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 . . . . . 0 C--O 1.236 0.375 0 C-N-CA 128.24 2.616 . . . . 0.0 104.48 172.791 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.721 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -67.61 -17.86 64.77 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.277 1.031 . . . . 0.0 113.739 -177.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.16 63.19 2.37 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.677 1.191 . . . . 0.0 111.777 -171.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.4 mttm -123.27 166.91 14.47 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 127.494 2.318 . . . . 0.0 107.025 171.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 10.4 m-30 -68.52 171.86 6.93 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 122.375 1.083 . . . . 0.0 109.255 165.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -137.17 155.97 48.91 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 126.929 2.092 . . . . 0.0 107.243 -170.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -49.68 -49.22 48.39 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.444 1.098 . . . . 0.0 110.722 175.218 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -44.82 -56.9 4.1 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.319 1.448 . . . . 0.0 112.332 172.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.1 mm-40 -70.92 -39.24 72.82 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.276 1.03 . . . . 0.0 110.602 -171.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 79.2 mt -64.86 -31.72 55.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 C-N-CA 124.247 1.019 . . . . 0.0 109.237 175.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -49.44 -55.22 13.68 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 125.759 1.647 . . . . 0.0 111.843 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 73.0 t -68.31 -39.39 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 119.026 -0.512 . . . . 0.0 109.64 -173.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.9 mp -62.0 -52.74 62.78 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.908 0.776 . . . . 0.0 111.034 177.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.19 -31.43 72.57 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.574 0.625 . . . . 0.0 111.049 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.5 -27.24 70.56 Favored Glycine 0 CA--C 1.531 1.042 0 CA-C-N 118.637 0.653 . . . . 0.0 112.988 172.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 79.5 mt -74.25 -27.45 60.77 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 119.977 1.889 . . . . 0.0 112.098 177.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.8 -25.92 64.93 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.891 170.305 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 30.1 mm -130.86 87.44 0.98 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 124.601 1.16 . . . . 0.0 108.68 -166.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.96 60.29 0.62 Allowed Pre-proline 0 CA--C 1.544 0.728 0 C-N-CA 125.009 1.324 . . . . 0.0 111.552 172.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -57.94 -37.52 95.79 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 123.236 2.624 . . . . 0.0 111.601 -179.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -60.07 -41.66 92.89 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 123.376 0.67 . . . . 0.0 111.434 -178.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 37.1 t90 -61.16 -57.64 11.64 Favored 'General case' 0 C--O 1.227 -0.11 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 176.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 tt -50.25 -48.26 54.81 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.529 0.732 . . . . 0.0 110.337 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -63.95 -45.4 89.35 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.836 0.854 . . . . 0.0 111.376 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -59.89 -40.41 88.63 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.93 0.786 . . . . 0.0 111.208 173.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -63.68 -54.34 37.05 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -178.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 30.0 mm -55.49 -41.72 64.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.407 1.083 . . . . 0.0 109.691 178.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.84 7.21 1.64 Allowed 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -179.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -137.35 21.71 2.96 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.364 -0.835 . . . . 0.0 110.731 159.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.2 t30 50.95 25.0 2.02 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 127.373 2.269 . . . . 0.0 112.96 -175.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -81.24 -15.23 56.22 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 119.909 -1.744 . . . . 0.0 112.721 -174.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 34.8 tp -69.45 133.64 47.98 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 119.459 1.027 . . . . 0.0 109.044 -175.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 61.8 t -112.91 154.79 14.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 106.257 -1.757 . . . . 0.0 106.257 169.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -123.0 145.97 48.04 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 128.394 2.678 . . . . 0.0 107.209 173.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -162.86 171.13 38.58 Favored Glycine 0 C--N 1.332 0.348 0 O-C-N 121.166 -0.959 . . . . 0.0 113.687 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 31.4 mm -114.98 133.38 61.33 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.595 0 C-N-CA 126.804 2.042 . . . . 0.0 106.417 178.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.534 ' HA ' HG11 ' A' ' 61' ' ' VAL . 0.5 OUTLIER -44.5 -54.21 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.427 -1.589 1 C-N-CA 133.237 4.615 . . . . 0.0 112.266 169.271 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 19.8 mttt 62.89 159.65 0.12 Allowed Pre-proline 0 CA--C 1.536 0.421 0 C-N-CA 126.666 1.987 . . . . 0.0 112.971 179.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -70.75 -12.28 30.79 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.324 2.682 . . . . 0.0 113.278 -178.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 47.8 m -149.55 90.69 1.74 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.366 1.466 . . . . 0.0 107.795 170.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -138.92 -165.16 1.78 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 156.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.7 t -92.71 36.76 1.01 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 125.336 1.454 . . . . 0.0 112.585 -170.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.534 HG11 ' HA ' ' A' ' 55' ' ' VAL . 9.5 m -105.73 153.24 40.1 Favored Pre-proline 0 C--N 1.324 -0.539 0 C-N-CA 123.43 0.692 . . . . 0.0 109.252 -167.229 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.99 178.04 4.47 Favored 'Trans proline' 0 N--CA 1.457 -0.654 0 C-N-CA 122.998 2.465 . . . . 0.0 111.311 -174.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -80.92 160.04 24.8 Favored 'General case' 0 C--O 1.238 0.482 0 O-C-N 121.185 -0.947 . . . . 0.0 109.35 170.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 70.9 33.74 65.81 Favored Glycine 0 CA--C 1.529 0.967 0 CA-C-O 119.615 -0.547 . . . . 0.0 112.117 176.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 9.2 m -146.34 25.38 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 125.923 1.689 . . . . 0.0 110.398 176.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.47 -5.14 0.3 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 127.778 2.431 . . . . 0.0 116.674 -164.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.2 t0 -157.57 15.98 0.25 Allowed 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 127.187 2.195 . . . . 0.0 109.883 -179.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.491 ' CE2' ' HE3' ' A' ' 94' ' ' LYS . 5.6 m-85 -86.98 100.83 12.89 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 -178.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.23 148.6 8.24 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.685 0.675 . . . . 0.0 110.076 174.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 46.6 p90 -123.38 166.78 14.76 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 124.422 1.089 . . . . 0.0 111.244 -179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 31.2 mt -136.27 130.46 33.03 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 127.564 2.346 . . . . 0.0 105.282 176.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 5.1 p -148.96 151.77 12.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 107.377 -1.342 . . . . 0.0 107.377 176.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -86.49 143.89 27.52 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.56 1.073 . . . . 0.0 109.003 176.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.19 -10.26 4.3 Favored 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 128.246 2.618 . . . . 0.0 114.604 -171.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.83 7.05 4.37 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.804 1.241 . . . . 0.0 111.609 -175.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -134.58 31.82 3.37 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 126.188 1.795 . . . . 0.0 107.215 -178.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -67.87 -18.69 64.89 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 125.449 1.5 . . . . 0.0 113.116 -166.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -119.75 20.66 12.24 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.59 1.956 . . . . 0.0 109.471 174.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -107.2 -98.36 2.56 Favored Glycine 0 C--N 1.338 0.66 0 C-N-CA 126.535 2.017 . . . . 0.0 109.478 -178.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.4 m -74.58 162.28 28.92 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.603 1.161 . . . . 0.0 108.57 169.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 6.9 tt -161.42 154.83 3.46 Favored 'Isoleucine or valine' 0 C--O 1.239 0.531 0 O-C-N 121.005 -1.059 . . . . 0.0 108.741 153.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.54 HG23 ' HB3' ' A' ' 95' ' ' TYR . 3.6 mt -138.34 147.77 25.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 175.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -133.39 156.66 47.26 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 127.894 2.477 . . . . 0.0 108.567 -174.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -162.7 159.61 24.54 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 120.408 -1.432 . . . . 0.0 111.174 174.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.52 115.88 6.2 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.94 1.296 . . . . 0.0 109.875 176.3 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.544 ' HA ' HG22 ' A' ' 91' ' ' VAL . . . -70.26 96.84 1.15 Allowed 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.712 0.805 . . . . 0.0 109.482 167.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -64.18 -17.23 63.32 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.867 -0.587 . . . . 0.0 111.052 163.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 100.78 122.61 4.99 Favored Glycine 0 C--N 1.339 0.697 0 N-CA-C 108.409 -1.876 . . . . 0.0 108.409 175.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 60.35 -7.14 0.08 Allowed 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 126.067 1.747 . . . . 0.0 113.614 -161.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.07 146.29 36.96 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 128.148 2.579 . . . . 0.0 107.861 178.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.544 HG22 ' HA ' ' A' ' 86' ' ' ALA . 41.2 t -132.82 114.32 21.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 172.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.421 ' N ' HD12 ' A' ' 92' ' ' ILE . 2.8 mp -79.71 105.25 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.798 0 N-CA-C 104.544 -2.391 . . . . 0.0 104.544 171.455 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 2.9 mt -77.32 142.09 14.7 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 106.359 -1.719 . . . . 0.0 106.359 169.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.491 ' HE3' ' CE2' ' A' ' 68' ' ' TYR . 88.6 mttt -132.13 123.52 27.28 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 124.904 1.281 . . . . 0.0 108.615 171.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.54 ' HB3' HG23 ' A' ' 82' ' ' ILE . 43.7 p90 -142.22 166.76 23.81 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 120.901 -1.124 . . . . 0.0 111.126 -176.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.4 t -154.19 175.83 13.0 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 124.523 1.129 . . . . 0.0 109.259 -172.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 93.2 p -119.78 3.84 11.06 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.273 1.029 . . . . 0.0 111.811 166.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -137.85 141.64 40.75 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 157.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.0 ttp180 -50.7 -42.47 57.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.56 1.144 . . . . 0.0 109.972 174.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -95.04 24.82 4.57 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 129.066 2.946 . . . . 0.0 113.454 -173.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 67.7 p -126.74 159.12 34.66 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 120.793 1.633 . . . . 0.0 109.359 170.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 45.0 tptt -64.87 130.26 42.79 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 121.372 -0.83 . . . . 0.0 110.019 -174.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.45 152.38 34.52 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.243 1.817 . . . . 0.0 110.815 177.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -73.75 174.88 7.79 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 125.919 1.688 . . . . 0.0 109.804 168.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -119.24 132.33 55.91 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.049 1.339 . . . . 0.0 109.145 168.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -146.01 130.41 17.71 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 167.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -140.53 92.16 2.49 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 119.829 1.195 . . . . 0.0 109.586 -167.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.05 166.45 11.23 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 124.045 0.938 . . . . 0.0 109.203 -174.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 42.0 p -84.93 161.99 19.61 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 123.088 0.555 . . . . 0.0 112.043 177.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 40.8 mt -57.78 -40.1 79.02 Favored 'General case' 0 C--N 1.34 0.191 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 174.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.45 -37.0 82.3 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-O 116.238 -1.839 . . . . 0.0 111.554 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.28 -63.83 1.0 Allowed 'General case' 0 C--N 1.347 0.496 0 CA-C-N 121.64 2.018 . . . . 0.0 110.746 169.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 29.2 mt -55.84 -34.36 65.34 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.214 0.531 . . . . 0.0 110.893 -175.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -71.17 -40.4 71.31 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.148 0.579 . . . . 0.0 111.174 178.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.77 -14.64 61.58 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 124.646 1.178 . . . . 0.0 112.236 176.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -101.08 -41.76 6.64 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 123.456 0.703 . . . . 0.0 110.227 -173.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -130.98 -0.5 4.17 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -168.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.476 ' C ' HE22 ' A' ' 123' ' ' GLN . 4.4 t80 -136.11 54.77 1.88 Allowed 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 122.912 1.339 . . . . 0.0 110.617 -176.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -88.25 -59.04 2.35 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 127.561 2.344 . . . . 0.0 114.728 174.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.9 p -77.57 -166.96 0.84 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.882 1.673 . . . . 0.0 111.886 -164.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.24 -51.16 3.01 Favored 'General case' 0 CA--C 1.522 -0.103 0 C-N-CA 124.701 1.201 . . . . 0.0 108.604 -178.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.6 t -57.65 -30.44 65.41 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.262 1.825 . . . . 0.0 112.041 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.476 HE22 ' C ' ' A' ' 118' ' ' TYR . 10.5 pt20 -53.68 -32.4 51.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 120.668 1.576 . . . . 0.0 111.559 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.3 mttm -68.37 0.42 3.92 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 125.108 1.363 . . . . 0.0 112.361 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -108.78 0.19 20.28 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 125.566 1.546 . . . . 0.0 111.325 175.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -121.4 -64.7 1.2 Allowed 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 125.538 1.535 . . . . 0.0 107.478 173.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 21.9 t -52.23 -47.31 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.468 1.507 . . . . 0.0 111.056 -178.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -67.94 -32.31 72.66 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.35 0.871 . . . . 0.0 113.35 175.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -75.97 -35.02 59.81 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 126.672 1.989 . . . . 0.0 110.594 -172.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -60.89 -33.96 73.92 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 127.678 2.391 . . . . 0.0 111.172 171.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 52.7 t -66.37 -22.24 29.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 O-C-N 121.317 -0.865 . . . . 0.0 110.689 177.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -98.04 -12.26 22.08 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.611 1.164 . . . . 0.0 112.413 171.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.6 12.1 66.35 Favored Glycine 0 CA--C 1.528 0.867 0 C-N-CA 125.402 1.477 . . . . 0.0 112.414 178.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 3.9 pp -119.28 177.27 4.96 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 125.886 1.674 . . . . 0.0 109.405 174.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 80.5 mtp180 -130.65 176.03 8.52 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 127.029 2.132 . . . . 0.0 108.754 -168.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -133.69 -0.67 3.15 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.368 0.985 . . . . 0.0 113.087 -175.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.252 1.197 0 C-N-CA 127.763 2.425 . . . . 0.0 107.104 -155.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.009 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.3 p80 45.19 28.04 0.38 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 128.448 2.699 . . . . 0.0 116.425 173.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -155.95 174.28 15.57 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 127.553 2.341 . . . . 0.0 106.143 170.195 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 ptmt 50.99 28.99 4.15 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.772 2.029 . . . . 0.0 115.564 168.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 61.19 172.48 0.11 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 128.718 2.807 . . . . 0.0 111.148 -170.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.2 p -110.96 149.64 30.38 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 120.953 -1.092 . . . . 0.0 109.458 176.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -54.71 -31.02 57.55 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.381 1.472 . . . . 0.0 111.335 -176.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.0 mt-30 -59.87 -60.1 4.37 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 129.369 3.067 . . . . 0.0 110.742 174.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -69.59 -36.44 76.25 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.623 1.569 . . . . 0.0 109.473 -172.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 82.9 mt -62.34 -39.49 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 123.648 0.779 . . . . 0.0 109.131 170.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -53.21 -55.13 25.87 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 124.747 1.165 . . . . 0.0 111.879 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 50.5 t -61.44 -41.88 91.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-N 118.311 1.055 . . . . 0.0 110.51 179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 48.1 mt -62.14 -49.27 76.53 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 118.818 0.735 . . . . 0.0 111.055 -177.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -62.26 -39.53 93.2 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 122.429 0.292 . . . . 0.0 110.967 175.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.85 -32.91 85.75 Favored Glycine 0 C--O 1.222 -0.654 0 CA-C-O 119.07 -0.85 . . . . 0.0 111.634 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.533 HD12 HD21 ' A' ' 41' ' ' LEU . 7.2 mp -65.57 -30.48 71.22 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 120.342 2.071 . . . . 0.0 112.496 177.255 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.16 -26.17 68.41 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 118.916 -0.564 . . . . 0.0 111.384 175.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.403 HG21 ' HB3' ' A' ' 95' ' ' TYR . 44.6 mm -131.18 99.93 4.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.523 0 C-N-CA 126.208 1.803 . . . . 0.0 106.854 -165.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . 0.278 1.5 p 57.24 56.32 7.77 Favored Pre-proline 0 CA--C 1.549 0.918 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.808 174.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -59.14 -38.33 87.15 Favored 'Trans proline' 0 C--N 1.358 1.028 0 C-N-CA 123.82 3.014 . . . . 0.0 110.185 179.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -63.14 -46.08 88.92 Favored 'General case' 0 N--CA 1.461 0.087 0 C-N-CA 123.997 0.919 . . . . 0.0 110.906 -176.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 19.0 t90 -57.19 -46.1 83.13 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 172.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.533 HD21 HD12 ' A' ' 34' ' ' LEU . 0.1 OUTLIER -63.21 -50.35 70.63 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 106.463 -1.681 . . . . 0.0 106.463 -172.018 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -63.53 -40.33 96.76 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 125.372 1.469 . . . . 0.0 111.565 -178.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -57.06 -40.48 76.91 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.948 1.249 . . . . 0.0 110.603 175.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 49.6 m-80 -81.03 -39.12 26.32 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-O 117.2 -1.381 . . . . 0.0 111.141 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 28.3 mm -57.45 -47.0 85.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-N 121.207 1.821 . . . . 0.0 108.73 173.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.69 -5.86 9.78 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -176.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -124.68 15.63 8.75 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 125.377 1.471 . . . . 0.0 112.495 173.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 66.44 6.7 4.5 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 126.043 1.737 . . . . 0.0 113.985 178.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.64 -13.67 56.07 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 120.446 -1.409 . . . . 0.0 112.235 -159.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -98.92 114.97 27.84 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 118.704 0.684 . . . . 0.0 110.728 -158.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 38.3 t -95.96 164.46 2.16 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 125.137 1.375 . . . . 0.0 108.601 -177.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -143.49 138.28 29.11 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 128.977 2.911 . . . . 0.0 105.343 -176.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -157.68 177.58 34.4 Favored Glycine 0 C--N 1.333 0.407 0 CA-C-N 118.313 0.506 . . . . 0.0 112.346 173.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 15.7 mm -101.4 140.17 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.15 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 164.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 26.0 t -44.46 -64.54 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.691 0 C-N-CA 127.204 2.201 . . . . 0.0 111.469 176.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 29.4 mttt 57.57 165.53 0.07 OUTLIER Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 126.065 1.746 . . . . 0.0 112.037 -170.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -76.69 -11.39 18.5 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 121.714 1.609 . . . . 0.0 112.832 176.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.3 m -97.12 23.93 6.85 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.423 1.489 . . . . 0.0 112.788 -163.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -139.94 -164.88 1.78 Allowed 'General case' 0 C--O 1.241 0.607 0 C-N-CA 127.176 2.191 . . . . 0.0 106.653 176.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 24.8 m -125.45 98.02 5.43 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 120.472 -1.392 . . . . 0.0 109.525 -166.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 3.2 m -137.57 157.73 73.21 Favored Pre-proline 0 C--O 1.241 0.645 0 C-N-CA 124.002 0.921 . . . . 0.0 113.054 -166.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.3 171.26 10.65 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 123.621 2.881 . . . . 0.0 110.602 171.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -74.32 158.19 34.43 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 121.594 -0.691 . . . . 0.0 111.735 179.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 72.49 31.32 63.26 Favored Glycine 0 CA--C 1.526 0.744 0 C-N-CA 124.009 0.814 . . . . 0.0 113.01 167.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 10.6 m -132.94 26.03 1.26 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 124.552 1.141 . . . . 0.0 110.317 174.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -63.97 -10.79 23.46 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 -154.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -151.39 31.76 0.59 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.863 2.065 . . . . 0.0 108.58 174.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -75.11 153.24 38.39 Favored 'General case' 0 C--O 1.232 0.151 0 O-C-N 120.919 -1.113 . . . . 0.0 108.49 173.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 51.2 m -72.83 154.48 40.6 Favored 'General case' 0 N--CA 1.437 -1.125 0 C-N-CA 123.712 0.805 . . . . 0.0 109.014 156.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -138.48 165.95 25.52 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 124.594 1.158 . . . . 0.0 109.823 167.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 23.3 mt -140.47 125.78 18.78 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 127.288 2.235 . . . . 0.0 105.504 177.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 8.2 p -148.23 150.94 13.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 174.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -89.66 159.26 17.21 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.784 0.802 . . . . 0.0 109.976 178.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.08 -18.03 63.94 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.199 1.0 . . . . 0.0 113.255 -168.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -102.97 -32.25 9.83 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 123.305 0.642 . . . . 0.0 111.536 176.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.97 9.65 0.52 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 129.038 2.935 . . . . 0.0 112.65 -176.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -56.41 -26.11 52.29 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 120.611 1.55 . . . . 0.0 113.618 -158.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -105.83 -5.88 19.43 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 120.695 1.589 . . . . 0.0 113.66 174.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -86.53 -93.64 0.88 Allowed Glycine 0 CA--C 1.527 0.782 0 C-N-CA 124.852 1.215 . . . . 0.0 111.75 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.95 171.05 9.56 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.549 0.74 . . . . 0.0 110.133 -170.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 9.0 tt -173.58 158.65 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 126.494 1.918 . . . . 0.0 106.944 162.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.425 HG23 ' HB3' ' A' ' 95' ' ' TYR . 22.8 mt -134.86 142.53 40.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 106.638 -1.615 . . . . 0.0 106.638 166.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -115.38 154.34 29.38 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.974 1.31 . . . . 0.0 108.541 174.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 1.4 p90 -158.65 148.1 19.19 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 125.349 1.459 . . . . 0.0 108.252 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -140.48 138.17 34.42 Favored 'General case' 0 CA--C 1.512 -0.501 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 168.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -89.52 134.96 33.87 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 172.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -130.29 88.15 2.61 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 127.248 2.219 . . . . 0.0 108.658 174.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 69.69 -82.5 0.3 Allowed Glycine 0 C--N 1.336 0.541 0 C-N-CA 125.235 1.398 . . . . 0.0 113.078 170.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -123.79 9.93 8.91 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 126.815 2.046 . . . . 0.0 110.95 178.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 5.7 m -124.14 157.11 35.44 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 127.324 2.25 . . . . 0.0 108.51 -179.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 80.8 t -132.44 128.51 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 126.73 2.012 . . . . 0.0 105.882 168.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 20.1 mm -102.35 98.94 7.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.498 0 N-CA-C 105.267 -2.123 . . . . 0.0 105.267 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 14.3 mt -83.44 130.67 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.775 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 177.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -134.53 91.26 2.76 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.879 1.672 . . . . 0.0 108.606 -175.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.425 ' HB3' HG23 ' A' ' 82' ' ' ILE . 31.0 p90 -108.48 170.36 8.07 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.807 -1.183 . . . . 0.0 111.645 -173.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.4 t -159.01 173.72 16.04 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.899 1.28 . . . . 0.0 110.152 -177.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.9 m -121.7 12.9 10.72 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.08 2.552 . . . . 0.0 111.485 167.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 29.8 mt-30 -144.27 127.11 16.29 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 160.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -49.22 -39.34 29.52 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.593 0.757 . . . . 0.0 110.712 170.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -82.75 31.41 0.42 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.155 1.782 . . . . 0.0 113.628 -177.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 45.6 p -139.22 163.36 32.67 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 119.519 -1.988 . . . . 0.0 112.741 178.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.541 ' HE3' ' HA ' ' A' ' 102' ' ' LYS . 0.4 OUTLIER -58.44 153.92 14.87 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.611 1.164 . . . . 0.0 110.028 169.387 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -105.54 156.17 18.48 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 125.259 1.424 . . . . 0.0 110.789 -169.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.17 179.04 1.66 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.834 1.254 . . . . 0.0 112.0 173.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -123.07 124.9 44.14 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.707 1.203 . . . . 0.0 109.413 168.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.5 tptt -144.76 105.95 4.2 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 103.911 -2.625 . . . . 0.0 103.911 168.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -118.05 109.34 16.33 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 -172.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 27.0 mt -125.14 144.56 50.37 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -166.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 15.9 p -68.52 151.7 46.41 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.952 0.796 . . . . 0.0 109.834 172.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 26.8 mt -55.72 -36.0 66.75 Favored 'General case' 0 CA--C 1.527 0.085 0 O-C-N 121.426 -0.796 . . . . 0.0 111.211 168.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 19.4 t -61.53 -44.52 96.9 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 118.485 -0.769 . . . . 0.0 110.021 173.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.83 -60.81 2.85 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.411 1.085 . . . . 0.0 109.891 178.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 48.0 mt -55.91 -33.52 64.74 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 123.07 0.548 . . . . 0.0 111.948 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 -43.9 77.28 Favored 'General case' 0 CA--C 1.531 0.243 0 O-C-N 121.665 -0.647 . . . . 0.0 109.29 176.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -25.21 61.46 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 117.904 -1.046 . . . . 0.0 111.665 -179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -71.72 -66.61 0.61 Allowed 'General case' 0 C--O 1.223 -0.299 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 169.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -117.22 22.98 12.15 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.851 -1.156 . . . . 0.0 112.763 -158.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -151.06 26.55 0.71 Allowed 'General case' 0 C--O 1.239 0.542 0 O-C-N 120.744 -1.223 . . . . 0.0 112.632 -179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.581 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.6 OUTLIER -67.24 -59.62 3.27 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -172.514 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 17.9 p -77.81 172.03 14.07 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 125.016 1.327 . . . . 0.0 110.812 -171.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.83 -50.12 8.4 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 171.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -41.21 63.41 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 124.514 1.126 . . . . 0.0 110.92 -176.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.581 HE22 ' NE2' ' A' ' 119' ' ' GLN . 6.4 tt0 -48.17 -45.57 33.67 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.734 1.214 . . . . 0.0 111.497 178.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -59.34 -20.37 54.1 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.795 1.638 . . . . 0.0 113.49 -169.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 6.3 mpt_? -55.0 -70.7 0.1 Allowed 'General case' 0 CA--C 1.517 -0.311 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 170.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -57.57 -41.97 82.14 Favored 'General case' 0 C--O 1.222 -0.373 0 O-C-N 123.769 0.668 . . . . 0.0 111.467 -174.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 17.7 t -54.21 -59.0 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 O-C-N 123.919 0.762 . . . . 0.0 109.794 -179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -57.47 -34.04 68.61 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 123.169 0.293 . . . . 0.0 111.238 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -64.52 -42.15 95.95 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.961 1.304 . . . . 0.0 110.958 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -58.78 -45.76 89.1 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.032 -1.043 . . . . 0.0 109.837 171.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 19.0 t -64.74 -31.1 52.33 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 O-C-N 121.844 -0.535 . . . . 0.0 110.89 179.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -84.84 -15.03 46.13 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.452 1.101 . . . . 0.0 113.181 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -96.94 -32.6 6.41 Favored Glycine 0 C--N 1.334 0.421 0 C-N-CA 124.123 0.868 . . . . 0.0 111.808 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.2 pp -58.56 151.52 20.31 Favored 'General case' 0 C--O 1.231 0.089 0 CA-C-N 118.087 0.944 . . . . 0.0 112.177 -173.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 56.6 mtp85 -92.37 153.26 19.29 Favored 'General case' 0 CA--C 1.521 -0.159 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 174.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 1.9 m -131.19 25.37 4.89 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.846 1.258 . . . . 0.0 109.635 173.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 128.917 2.887 . . . . 0.0 110.949 -164.141 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.642 0 CA-C-O 119.405 -0.664 . . . . 0.0 111.566 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -153.38 29.73 0.49 Allowed 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.036 1.334 . . . . 0.0 111.286 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 3.1 ttt -101.74 66.45 1.06 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 107.169 -1.419 . . . . 0.0 107.169 167.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.8 pttp -140.93 37.1 1.77 Allowed 'General case' 0 N--CA 1.467 0.397 0 O-C-N 120.969 -1.082 . . . . 0.0 112.089 -172.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 31.6 m-85 55.76 -171.85 0.07 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.363 1.465 . . . . 0.0 110.433 -162.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -122.35 152.69 39.9 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.548 1.539 . . . . 0.0 109.534 -175.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.59 -55.62 5.03 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 125.707 1.603 . . . . 0.0 111.354 177.039 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -44.91 -63.21 0.97 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.651 1.58 . . . . 0.0 110.359 174.653 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.404 ' NE2' HG11 ' A' ' 131' ' ' VAL . 69.7 mm-40 -54.65 -59.64 4.43 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.108 0.963 . . . . 0.0 109.241 -176.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 35.8 mt -56.91 -34.63 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 125.438 1.495 . . . . 0.0 110.395 -170.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -62.56 -28.38 71.26 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 117.958 -1.468 . . . . 0.0 114.065 -178.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 72.4 t -71.95 -40.71 68.43 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.183 0 CA-C-N 119.027 1.414 . . . . 0.0 108.635 177.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -62.89 -43.8 97.83 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.218 0.607 . . . . 0.0 109.71 176.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.88 -43.58 95.61 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 122.081 -0.387 . . . . 0.0 110.931 174.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.39 -30.21 75.0 Favored Glycine 0 C--O 1.222 -0.604 0 N-CA-C 110.633 -0.987 . . . . 0.0 110.633 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.9 tp -69.33 -24.0 63.86 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 120.49 -1.594 . . . . 0.0 112.018 -178.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.85 -21.46 62.42 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.849 -0.596 . . . . 0.0 111.793 170.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.441 HD12 ' CE2' ' A' ' 95' ' ' TYR . 28.7 mm -135.52 92.89 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 C-N-CA 126.261 1.824 . . . . 0.0 107.539 -158.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 74.7 m 60.2 54.91 4.05 Favored Pre-proline 0 CA--C 1.553 1.063 0 O-C-N 121.348 -0.845 . . . . 0.0 112.176 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -60.03 -38.15 79.88 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.968 3.112 . . . . 0.0 111.796 179.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -55.71 -52.65 63.15 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.699 1.199 . . . . 0.0 109.68 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' TRP . . . . . . . . . . . . . 30.5 t90 -61.43 -38.26 86.52 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.684 1.194 . . . . 0.0 111.054 177.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -52.89 58.17 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -62.38 -43.16 99.48 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.866 0.866 . . . . 0.0 111.743 -175.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -61.25 -44.0 97.96 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 119.248 0.931 . . . . 0.0 110.045 -176.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.4 m-80 -69.64 -35.89 75.6 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 117.289 -1.339 . . . . 0.0 112.422 -176.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 38.9 mm -56.5 -53.67 37.94 Favored 'Isoleucine or valine' 0 C--N 1.339 0.149 0 CA-C-N 119.215 0.916 . . . . 0.0 109.469 168.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.75 -21.7 66.06 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -177.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.95 -8.13 58.87 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 126.752 2.021 . . . . 0.0 113.663 169.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 44.89 43.55 7.15 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 127.238 2.215 . . . . 0.0 110.531 -169.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.3 mm100 -103.53 -2.13 27.26 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.407 2.283 . . . . 0.0 115.06 -177.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.13 135.06 44.38 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.011 1.324 . . . . 0.0 110.664 -160.049 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 71.7 t -120.4 117.45 53.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 C-N-CA 124.462 1.105 . . . . 0.0 108.041 -175.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.462 ' CD2' HG23 ' A' ' 136' ' ' THR . 23.3 t80 -80.76 152.64 28.21 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.604 1.562 . . . . 0.0 108.357 163.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -173.79 165.32 37.11 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.422 -1.071 . . . . 0.0 110.422 171.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 36.1 mm -104.06 141.7 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 170.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.57 HG13 HG11 ' A' ' 61' ' ' VAL . 24.1 t -44.23 -71.66 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 C-N-CA 127.322 2.249 . . . . 0.0 114.43 -171.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.1 mptt 55.77 165.8 0.06 OUTLIER Pre-proline 0 CA--C 1.542 0.651 0 C-N-CA 125.281 1.432 . . . . 0.0 113.777 -169.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.64 -4.39 14.52 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.11 2.54 . . . . 0.0 113.86 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.32 -70.37 0.1 Allowed 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.127 2.171 . . . . 0.0 112.388 -174.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.5 171.39 13.43 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.124 0.97 . . . . 0.0 109.042 -179.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.9 t -66.04 142.03 57.95 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 165.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.57 HG11 HG13 ' A' ' 55' ' ' VAL . 0.3 OUTLIER -152.62 158.27 33.29 Favored Pre-proline 0 C--O 1.242 0.67 0 C-N-CA 123.658 0.783 . . . . 0.0 110.176 169.223 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.88 178.79 3.7 Favored 'Trans proline' 0 N--CA 1.454 -0.839 0 C-N-CA 124.34 3.36 . . . . 0.0 111.197 166.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -76.2 167.78 21.24 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.346 -0.846 . . . . 0.0 111.391 178.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 71.44 18.72 77.18 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-O 118.603 -1.11 . . . . 0.0 114.402 165.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.2 m -130.24 21.88 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 118.764 1.282 . . . . 0.0 112.402 -174.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.74 -17.27 3.26 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 118.43 2.752 . . . . 0.0 118.43 -162.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -149.57 18.91 0.93 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 127.237 2.215 . . . . 0.0 109.195 -174.403 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.442 ' CD1' ' HG3' ' A' ' 85' ' ' LYS . 3.1 m-85 -69.7 148.86 48.69 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 171.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.0 t -67.23 161.56 24.59 Favored 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 155.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 22.2 p90 -141.99 141.92 32.91 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 114.092 -1.413 . . . . 0.0 109.814 161.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.1 133.75 52.88 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 172.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 9.7 p -156.79 149.96 10.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 174.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -74.25 170.32 15.8 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 119.709 1.14 . . . . 0.0 109.578 173.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.66 -29.98 63.89 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 122.134 0.968 . . . . 0.0 112.239 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -90.96 -37.61 13.38 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 127.51 2.324 . . . . 0.0 111.889 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . 0.279 0.0 OUTLIER -91.59 30.37 1.34 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.346 0.975 . . . . 0.0 111.859 -169.536 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 -45.57 -53.98 8.27 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.51 1.124 . . . . 0.0 112.878 179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -86.75 6.34 31.91 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.817 1.247 . . . . 0.0 112.537 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -92.17 -106.42 1.59 Allowed Glycine 0 CA--C 1.525 0.707 0 C-N-CA 126.68 2.086 . . . . 0.0 110.91 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 39.9 m -90.0 153.61 20.46 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.261 1.425 . . . . 0.0 108.893 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 7.4 tt -153.62 146.25 14.38 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 O-C-N 120.14 -1.6 . . . . 0.0 108.777 162.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 mt -128.39 113.05 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 178.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -90.77 143.43 26.73 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 173.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 17.2 p90 -148.6 160.18 43.36 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.983 -1.073 . . . . 0.0 111.612 170.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.442 ' HG3' ' CD1' ' A' ' 68' ' ' TYR . 1.3 tmtt? -148.91 129.37 13.9 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.073 0.949 . . . . 0.0 108.951 171.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . 0.424 ' HA ' HG22 ' A' ' 91' ' ' VAL . . . -104.82 115.27 30.02 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 124.053 0.941 . . . . 0.0 110.09 -174.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -126.41 99.24 5.75 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 127.403 2.281 . . . . 0.0 108.512 -165.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . 67.21 -83.13 0.13 Allowed Glycine 0 CA--C 1.531 1.032 0 C-N-CA 124.747 1.165 . . . . 0.0 114.821 173.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -133.78 20.82 3.86 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.242 2.217 . . . . 0.0 110.752 176.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.2 146.63 45.12 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 126.376 1.87 . . . . 0.0 109.022 -174.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' VAL . . . . . 0.424 HG22 ' HA ' ' A' ' 86' ' ' ALA . 96.8 t -131.72 124.53 54.09 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 169.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.468 ' N ' HD12 ' A' ' 92' ' ' ILE . 2.8 mp -93.04 101.47 12.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.893 0 N-CA-C 105.094 -2.187 . . . . 0.0 105.094 177.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 4.5 mt -92.67 121.13 43.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 178.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -121.13 96.05 4.94 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 126.742 2.017 . . . . 0.0 107.4 -175.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.441 ' CE2' HD12 ' A' ' 36' ' ' ILE . 34.5 p90 -113.45 168.26 9.9 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.386 -1.446 . . . . 0.0 111.421 -174.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 12.1 t -155.44 179.39 9.22 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.844 1.658 . . . . 0.0 107.195 177.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.2 p -122.19 2.4 9.79 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 127.056 2.143 . . . . 0.0 110.019 171.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -139.84 131.76 27.7 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-O 121.117 0.484 . . . . 0.0 111.363 164.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -3.26 3.8 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 128.486 2.715 . . . . 0.0 112.994 177.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -122.59 33.06 5.54 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 125.546 1.538 . . . . 0.0 110.264 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 65.4 p -130.43 -164.43 1.42 Allowed 'General case' 0 CA--C 1.546 0.809 0 O-C-N 120.686 -1.259 . . . . 0.0 112.695 178.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -100.58 154.28 18.7 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.231 1.413 . . . . 0.0 108.481 169.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -89.46 158.2 17.81 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.845 0.858 . . . . 0.0 110.354 -172.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -67.36 -178.91 0.92 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.443 1.097 . . . . 0.0 109.154 160.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -140.68 97.82 3.28 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -97.08 160.89 14.08 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 155.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -156.13 91.03 1.24 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.624 1.17 . . . . 0.0 107.857 169.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -96.34 163.45 13.07 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.611 0.764 . . . . 0.0 109.562 -178.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 40.9 p -81.46 163.01 23.05 Favored 'General case' 0 C--O 1.238 0.488 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 166.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 12.7 mt -56.37 -43.15 78.92 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 123.637 0.775 . . . . 0.0 109.007 169.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -62.79 -39.71 95.08 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.369 -0.824 . . . . 0.0 111.583 -176.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.8 -65.74 0.51 Allowed 'General case' 0 C--N 1.345 0.41 0 CA-C-O 118.537 -0.744 . . . . 0.0 109.321 168.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 93.9 mt -54.73 -30.74 57.03 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.221 1.009 . . . . 0.0 112.304 -174.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 59.7 tttt -66.31 -46.74 75.88 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.37 -7.69 58.83 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 124.609 1.163 . . . . 0.0 113.097 178.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -73.01 -66.13 0.71 Allowed 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 160.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -130.06 11.48 5.54 Favored 'General case' 0 N--CA 1.467 0.42 0 O-C-N 120.537 -1.352 . . . . 0.0 113.918 -154.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.482 ' CZ ' ' HE2' ' A' ' 124' ' ' LYS . 0.2 OUTLIER -140.65 22.48 2.32 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 120.796 -1.19 . . . . 0.0 111.622 179.324 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLN . . . . . 0.61 ' NE2' HE22 ' A' ' 123' ' ' GLN . 0.4 OUTLIER -73.77 -45.55 51.04 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 105.097 -2.186 . . . . 0.0 105.097 -163.19 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 2.8 t -91.52 150.83 21.02 Favored 'General case' 0 C--N 1.352 0.674 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -74.51 -20.34 60.01 Favored 'General case' 0 C--O 1.225 -0.219 0 CA-C-O 117.327 -1.32 . . . . 0.0 112.257 177.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 4.2 t -81.24 -32.4 33.38 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 120.212 1.369 . . . . 0.0 110.932 -178.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.61 HE22 ' NE2' ' A' ' 119' ' ' GLN . 7.8 pt20 -62.29 -26.77 68.59 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.981 1.264 . . . . 0.0 111.405 -176.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.482 ' HE2' ' CZ ' ' A' ' 118' ' ' TYR . 2.6 mtpm? -47.87 -29.61 3.42 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 125.986 1.714 . . . . 0.0 113.463 -179.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 34.6 ptt180 -52.67 -59.38 4.54 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.482 1.513 . . . . 0.0 110.26 175.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.73 -49.89 66.79 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 125.478 1.511 . . . . 0.0 110.013 -177.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 13.6 t -54.4 -54.85 18.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.405 -178.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -65.07 -25.62 67.88 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 178.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.8 m-20 -65.41 -34.75 79.04 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.704 172.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -66.08 -34.82 78.94 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 119.963 1.256 . . . . 0.0 111.098 173.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.404 HG11 ' NE2' ' A' ' 27' ' ' GLN . 18.2 t -73.41 -12.01 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 O-C-N 121.558 -0.714 . . . . 0.0 111.136 177.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -121.34 22.14 10.88 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.491 1.517 . . . . 0.0 111.951 -176.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -132.86 -0.13 4.39 Favored Glycine 0 CA--C 1.528 0.9 0 O-C-N 120.876 -1.14 . . . . 0.0 112.684 174.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 4.5 pp -76.26 -178.09 4.35 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 125.913 1.685 . . . . 0.0 111.632 173.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 1.1 mtt-85 -130.62 166.43 20.69 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 126.33 1.852 . . . . 0.0 107.013 164.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' THR . . . . . 0.462 HG23 ' CD2' ' A' ' 52' ' ' TYR . 2.3 m -122.73 -0.51 9.1 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 124.295 1.038 . . . . 0.0 111.013 177.199 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 C--O 1.246 0.884 0 CA-C-O 115.198 -2.334 . . . . 0.0 107.595 -149.151 . . . . . . . . 0 0 . 1 stop_ save_