data_2oq3_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 2oq3 _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 ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.484 1.249 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -58.71 121.09 10.2 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 169.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.79 -45.42 78.48 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.7 m -52.91 -28.03 21.45 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.29 1.436 . . . . 0.0 113.701 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -58.15 -27.53 63.88 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.771 0.829 . . . . 0.0 112.343 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -92.68 -7.26 47.3 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.886 0.875 . . . . 0.0 112.851 -177.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -108.7 106.01 57.99 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 119.967 1.258 . . . . 0.0 108.568 -171.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.87 -62.22 0.12 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.598 2.199 . . . . 0.0 113.299 -173.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -174.33 -65.93 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.67 1.188 . . . . 0.0 109.182 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.1 m -73.26 2.97 6.37 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.229 1.411 . . . . 0.0 112.604 -176.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.19 -4.01 15.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 128.436 2.694 . . . . 0.0 114.289 -169.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 21.0 mt -126.55 127.12 70.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 120.332 1.423 . . . . 0.0 108.188 -168.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.9 m -143.36 145.92 33.09 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.292 1.037 . . . . 0.0 111.308 -171.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.9 t -123.85 135.69 62.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 165.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 55.9 mt -138.7 143.06 33.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 -168.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 44.4 t60 -68.18 -49.25 62.11 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.812 -0.555 . . . . 0.0 110.037 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -160.07 145.11 14.98 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.628 1.571 . . . . 0.0 107.088 171.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.5 150.37 47.24 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 167.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -60.49 -40.64 92.05 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.578 0.351 . . . . 0.0 110.832 178.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -161.46 178.25 9.31 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.248 1.419 . . . . 0.0 108.886 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -32.94 63.51 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.915 0.886 . . . . 0.0 113.057 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -76.83 -42.67 39.41 Favored 'General case' 0 C--N 1.339 0.13 0 CA-C-N 119.842 1.201 . . . . 0.0 109.499 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -64.81 -29.06 70.0 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.976 0.353 . . . . 0.0 110.602 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.73 98.25 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.373 -0.83 . . . . 0.0 111.313 173.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.7 mt -67.0 -43.52 89.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -59.14 -47.21 86.13 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.403 0.547 . . . . 0.0 111.081 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -66.19 -20.89 66.27 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.069 0.85 . . . . 0.0 112.844 176.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.9 m -79.47 -8.24 58.99 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.223 0.919 . . . . 0.0 112.181 172.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.2 mmt -131.31 -24.74 2.27 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.9 0.88 . . . . 0.0 112.731 -166.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -58.99 -36.91 64.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 119.216 0.917 . . . . 0.0 111.383 -171.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -66.54 -24.48 66.38 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.61 -0.682 . . . . 0.0 112.819 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.2 mt -85.22 -41.23 15.8 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.871 0.869 . . . . 0.0 109.118 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.0 tp -58.81 -40.29 83.68 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.096 0.958 . . . . 0.0 110.61 175.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -62.5 -26.19 68.41 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.731 1.213 . . . . 0.0 112.935 -176.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -108.08 14.73 24.89 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.367 0.667 . . . . 0.0 110.738 176.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.254 10.8 p30 45.24 41.97 6.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.361 1.865 . . . . 0.0 113.698 -172.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -64.06 -22.29 66.87 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.973 -1.079 . . . . 0.0 110.766 159.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.6 pt -143.45 163.5 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 126.301 1.84 . . . . 0.0 109.011 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.1 m -97.56 163.73 12.73 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.979 1.712 . . . . 0.0 109.274 166.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -57.51 -35.47 70.3 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.598 0.759 . . . . 0.0 112.318 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -58.9 -30.65 67.96 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.143 0.577 . . . . 0.0 112.206 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.74 -45.06 93.36 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.166 0.587 . . . . 0.0 110.244 -179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.5 mp -64.1 -47.31 90.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -64.73 -31.02 72.06 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.62 -0.705 . . . . 0.0 111.567 -174.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.55 -42.24 96.18 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.211 0.914 . . . . 0.0 111.16 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 19.1 mt -67.11 -46.27 84.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.45 -49.31 77.77 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.248 0.476 . . . . 0.0 110.079 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.93 -41.65 99.55 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 123.234 0.614 . . . . 0.0 111.011 -177.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 28.0 m -64.68 -40.93 96.25 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.692 0.397 . . . . 0.0 111.228 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 89.5 m . . . . . 0 N--CA 1.452 -0.349 0 C-N-CA 123.866 0.866 . . . . 0.0 109.784 178.035 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 . . . . . 0 C--O 1.232 0.173 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.5 mm -112.62 131.1 65.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 104.945 -2.242 . . . . 0.0 104.945 169.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -116.71 -27.17 6.74 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 122.784 0.434 . . . . 0.0 111.464 -168.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.05 161.39 29.58 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 125.53 1.532 . . . . 0.0 107.158 174.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -47.91 115.63 1.57 Allowed 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.11 2.54 . . . . 0.0 111.085 170.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.52 3.66 71.43 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 117.928 -1.484 . . . . 0.0 114.508 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.1 t -129.95 127.25 63.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 119.781 1.79 . . . . 0.0 109.563 -169.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.29 168.8 17.91 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.069 1.347 . . . . 0.0 110.915 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.2 ttm -140.99 73.26 27.18 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 123.622 0.769 . . . . 0.0 110.947 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -50.38 122.68 9.85 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.991 2.46 . . . . 0.0 112.774 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -163.39 155.06 17.28 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.176 1.791 . . . . 0.0 107.471 -175.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.61 165.86 25.82 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.329 1.452 . . . . 0.0 108.077 171.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -60.63 153.25 63.23 Favored Pre-proline 0 N--CA 1.469 0.523 0 O-C-N 121.272 -0.892 . . . . 0.0 109.876 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -46.9 -46.75 17.86 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.218 2.612 . . . . 0.0 113.048 176.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -66.99 -11.05 55.79 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.601 1.16 . . . . 0.0 113.867 -177.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 80.8 m -74.39 -11.59 60.29 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.646 1.112 . . . . 0.0 112.355 172.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 136.42 24.23 0.5 Allowed Glycine 0 CA--C 1.526 0.735 0 CA-C-O 118.71 -1.05 . . . . 0.0 113.86 171.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.32 155.39 38.24 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 119.547 1.674 . . . . 0.0 109.069 168.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.8 mt -132.86 -25.78 1.82 Allowed 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.796 1.239 . . . . 0.0 111.063 -174.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -145.88 -168.72 3.06 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.652 1.981 . . . . 0.0 106.85 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 41.0 m -125.45 126.79 45.48 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.363 0.665 . . . . 0.0 109.582 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.37 -176.23 40.98 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.046 0.831 . . . . 0.0 111.73 -176.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 62.1 mtt -143.71 168.47 19.82 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.562 1.545 . . . . 0.0 111.401 -176.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.3 m -138.21 168.7 19.18 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.385 1.874 . . . . 0.0 108.478 171.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.4 tp -151.45 120.84 6.84 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.95 1.7 . . . . 0.0 107.425 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 42.4 m -136.17 129.02 31.07 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.8 tp -117.56 136.67 53.11 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 175.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.3 mp -115.48 116.15 27.72 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -59.41 -39.88 84.87 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.637 0.653 . . . . 0.0 111.621 -175.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -102.36 -2.31 29.16 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.38 0.672 . . . . 0.0 112.309 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 65.85 -175.05 18.5 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.198 0.904 . . . . 0.0 113.674 -176.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -150.59 149.03 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 167.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -86.67 119.27 26.73 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 172.508 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo . . . . . 0 N--CA 1.457 -0.646 0 CA-C-O 121.657 0.607 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 48.4 mm -88.39 135.73 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 177.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -109.86 -25.04 10.53 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.742 0.817 . . . . 0.0 111.487 172.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 55.4 tp -127.98 126.51 41.51 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -169.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mp -133.28 139.27 46.82 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 -178.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 4.7 mt -125.49 123.62 65.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 173.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.99 155.48 36.75 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 176.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -149.99 138.73 20.85 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 176.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 54.3 p -139.11 155.45 47.88 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.107 1.363 . . . . 0.0 108.815 164.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.57 140.79 22.22 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.485 0.714 . . . . 0.0 109.634 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.23 -16.99 59.71 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -154.4 154.81 33.89 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.645 1.178 . . . . 0.0 109.221 -173.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.46 -35.36 73.92 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.62 0.768 . . . . 0.0 112.79 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.52 -38.55 74.28 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 119.474 1.034 . . . . 0.0 110.429 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.1 m -63.55 -38.23 90.36 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.172 0.589 . . . . 0.0 110.31 173.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -59.45 -49.23 78.62 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.096 172.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.4 mm -58.97 -46.08 91.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 119.557 1.072 . . . . 0.0 109.876 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.06 -46.64 93.45 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-N 118.846 0.748 . . . . 0.0 111.342 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.08 -46.36 89.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.419 0.688 . . . . 0.0 111.232 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.3 mm -56.62 -51.95 59.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -59.14 -33.87 71.39 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 118.782 -0.628 . . . . 0.0 111.419 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -64.92 -56.31 14.08 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.764 0.711 . . . . 0.0 110.489 173.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . 0.275 1.4 pp -71.3 -17.41 62.46 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 -174.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.5 m -60.07 -27.28 66.84 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 120.155 1.343 . . . . 0.0 111.607 170.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.08 -12.29 49.08 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.026 0.83 . . . . 0.0 111.801 175.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 69.6 mt -111.78 -51.52 2.85 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.397 1.079 . . . . 0.0 109.428 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 13.6 mt -73.45 -19.95 60.83 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -170.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.4 m -108.95 21.02 17.76 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.92 0.888 . . . . 0.0 110.758 -177.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -128.04 100.04 5.72 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.44 -28.62 63.49 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.687 0.795 . . . . 0.0 112.599 -175.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.31 -39.17 93.37 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.137 0.575 . . . . 0.0 110.386 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.71 -40.29 47.07 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.1 mt -57.7 -43.94 85.54 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.997 0.817 . . . . 0.0 110.615 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -57.83 -51.45 69.54 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.457 0.571 . . . . 0.0 110.05 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -65.05 -33.35 75.83 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.732 0.413 . . . . 0.0 112.087 -175.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 63.3 mt -68.06 -47.37 68.51 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 173.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.0 mt -64.22 -34.87 79.08 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 118.891 -0.576 . . . . 0.0 111.743 -176.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 63.8 p -87.49 -0.66 57.15 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.088 0.858 . . . . 0.0 112.343 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.42 118.19 5.3 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.368 0.985 . . . . 0.0 111.23 -171.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.6 m -73.05 -20.17 61.03 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.174 0.59 . . . . 0.0 112.272 -177.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.5 p -155.68 164.65 38.32 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.592 0.71 . . . . 0.0 110.832 -170.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.09 -30.94 66.64 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.786 0.834 . . . . 0.0 110.528 170.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.0 tptt -64.61 -44.01 91.94 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.47 0.577 . . . . 0.0 110.53 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -67.55 -37.95 83.43 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.258 0.481 . . . . 0.0 110.225 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 56.0 mt -60.59 -45.85 92.43 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.331 0.514 . . . . 0.0 110.357 173.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.81 92.63 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.562 0.745 . . . . 0.0 111.637 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -56.52 -42.45 78.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.759 0.709 . . . . 0.0 110.995 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 70.9 mt -66.78 -35.02 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 122.98 0.512 . . . . 0.0 109.782 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 26.4 mm -64.68 -49.55 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 119.143 0.883 . . . . 0.0 109.316 172.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 38.4 m -59.03 -30.54 68.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.102 0.865 . . . . 0.0 112.392 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -65.93 -22.1 66.47 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.272 1.029 . . . . 0.0 112.415 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.945 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 -178.845 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 tpt . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.738 0.304 . . . . 0.0 110.946 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -68.99 109.48 3.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 169.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.18 -44.29 83.43 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.351 1.06 . . . . 0.0 109.81 -172.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.07 -23.43 20.22 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.723 1.209 . . . . 0.0 112.682 -175.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -58.94 -28.41 66.23 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.776 0.716 . . . . 0.0 111.981 176.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -92.48 -13.29 30.13 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 117.911 -1.043 . . . . 0.0 112.66 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -112.67 85.33 7.36 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 120.974 1.715 . . . . 0.0 107.215 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.58 -59.52 1.16 Allowed 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 123.724 2.949 . . . . 0.0 115.464 -169.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.526 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.8 tp10 -161.62 -77.02 0.05 Allowed 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 118.677 0.672 . . . . 0.0 112.271 -178.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -68.61 13.62 0.09 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.109 1.764 . . . . 0.0 111.843 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.526 ' H ' ' C ' ' A' ' 9' ' ' GLU . 5.5 m -75.65 8.7 2.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 128.508 2.723 . . . . 0.0 113.452 -168.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.4 mm -135.82 134.73 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 104.491 -2.411 . . . . 0.0 104.491 -169.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 75.7 m -155.33 147.31 23.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 118.83 0.741 . . . . 0.0 110.454 174.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 77.4 t -124.06 136.19 61.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 103.866 -2.642 . . . . 0.0 103.866 169.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.426 HG21 ' H ' ' A' ' 17' ' ' SER . 37.6 mt -139.0 147.86 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 N-CA-C 105.159 -2.163 . . . . 0.0 105.159 -169.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -66.87 -42.69 85.19 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.389 -0.819 . . . . 0.0 110.714 175.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.426 ' H ' HG21 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -167.4 145.7 4.81 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.923 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.41 155.19 36.63 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -60.26 -40.12 89.21 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 176.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -167.84 -177.06 3.29 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 128.019 2.528 . . . . 0.0 107.521 172.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -61.76 -33.78 74.69 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 177.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.447 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.7 mt-30 -59.75 -51.48 69.58 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.621 1.555 . . . . 0.0 107.433 172.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -60.57 -34.55 74.35 Favored 'General case' 0 C--O 1.223 -0.337 0 O-C-N 121.646 -0.659 . . . . 0.0 111.521 177.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.5 73.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.629 -0.67 . . . . 0.0 110.883 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.94 -47.47 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 171.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.68 -45.45 81.74 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.743 -0.598 . . . . 0.0 110.557 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -68.57 -17.46 64.14 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 118.048 -0.977 . . . . 0.0 112.64 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.9 m -80.25 -17.61 51.74 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 120.866 1.666 . . . . 0.0 111.87 169.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.8 mmt -125.0 -18.44 5.49 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -169.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.4 -36.23 62.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-N 120.437 1.471 . . . . 0.0 111.734 -169.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.8 m -63.15 -22.34 66.8 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.757 0.708 . . . . 0.0 112.269 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 80.7 mt -89.91 -41.68 11.65 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.24 1.016 . . . . 0.0 109.125 174.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -55.36 -42.15 73.52 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.61 0.764 . . . . 0.0 110.576 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.75 -24.26 66.19 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 125.816 1.646 . . . . 0.0 114.102 -171.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -111.01 21.96 15.84 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.029 0.377 . . . . 0.0 110.422 172.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 54.84 34.19 21.46 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.996 1.318 . . . . 0.0 113.166 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -68.37 -22.12 64.68 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 120.583 -1.323 . . . . 0.0 109.71 168.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.1 pt -142.2 174.69 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 126.74 2.016 . . . . 0.0 108.557 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 m -112.24 159.9 18.15 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 126.471 1.908 . . . . 0.0 107.813 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.2 -31.22 69.95 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.24 -0.913 . . . . 0.0 112.337 -174.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -58.09 -32.48 68.11 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.052 0.541 . . . . 0.0 112.004 175.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -61.13 -44.13 97.81 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.358 0.663 . . . . 0.0 110.48 -177.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.2 mp -59.17 -50.13 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 36.9 tp60 -69.37 -25.01 63.96 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.437 -0.792 . . . . 0.0 112.142 -175.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.56 98.99 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 119.699 1.136 . . . . 0.0 110.627 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.0 mt -68.4 -45.53 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.447 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.3 mttt -60.73 -41.08 94.61 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.382 0.537 . . . . 0.0 110.096 -178.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -65.15 -38.76 91.62 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.892 0.877 . . . . 0.0 111.41 177.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -63.05 -36.7 84.44 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.652 -0.655 . . . . 0.0 110.376 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.6 m . . . . . 0 CA--C 1.54 0.583 0 C-N-CA 124.04 0.936 . . . . 0.0 110.664 176.315 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 . . . . . 0 N--CA 1.449 -0.498 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.2 mm -138.59 140.88 38.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mp -132.58 -27.91 1.68 Allowed 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -169.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.2 160.88 24.22 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.77 114.42 1.36 Allowed 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.728 2.285 . . . . 0.0 111.15 174.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.39 12.5 72.85 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 118.137 -1.368 . . . . 0.0 114.19 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.86 127.15 63.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-N 119.722 1.761 . . . . 0.0 108.827 -174.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.71 169.46 12.52 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.61 1.564 . . . . 0.0 109.809 179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.5 ttm -143.51 67.98 16.69 Favored Pre-proline 0 CA--C 1.536 0.436 0 O-C-N 121.926 -0.484 . . . . 0.0 111.295 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.06 149.4 53.27 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 121.297 1.331 . . . . 0.0 113.066 -174.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 174.15 153.44 0.11 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 128.582 2.753 . . . . 0.0 106.28 -169.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.85 166.1 24.09 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 125.988 1.715 . . . . 0.0 106.903 172.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -52.71 147.86 14.36 Favored Pre-proline 0 CA--C 1.536 0.421 0 CA-C-O 118.526 -0.749 . . . . 0.0 109.352 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -47.44 -42.13 28.65 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.794 2.33 . . . . 0.0 112.281 174.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -62.77 -13.8 37.37 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.491 1.116 . . . . 0.0 113.712 -177.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 71.6 m -78.28 -0.68 29.69 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.857 0.753 . . . . 0.0 111.827 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.54 15.03 2.26 Favored Glycine 0 C--N 1.336 0.53 0 CA-C-O 118.32 -1.267 . . . . 0.0 112.929 171.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.33 147.96 52.54 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 119.42 1.61 . . . . 0.0 109.549 169.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.1 mt -131.32 -33.5 1.48 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.519 1.128 . . . . 0.0 110.402 -174.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -145.5 156.69 43.87 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.516 1.527 . . . . 0.0 108.104 177.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.9 m -90.14 132.68 35.32 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 122.984 0.514 . . . . 0.0 110.365 -176.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.01 -176.17 43.08 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.739 1.161 . . . . 0.0 110.8 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 46.9 mtt -148.9 170.87 17.32 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.552 1.941 . . . . 0.0 110.284 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.42 162.67 40.12 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.085 1.754 . . . . 0.0 108.339 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.1 tp -146.42 122.45 10.74 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 126.207 1.803 . . . . 0.0 108.338 -172.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 74.2 m -137.25 143.79 42.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.373 1.069 . . . . 0.0 108.522 -171.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.2 tt -141.81 131.65 24.35 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 177.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -107.25 118.08 35.77 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 126.769 2.027 . . . . 0.0 107.018 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -59.49 -34.73 72.94 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.985 0.812 . . . . 0.0 112.45 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -96.67 -10.6 26.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.03 0.932 . . . . 0.0 112.097 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.73 179.97 11.88 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -169.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -149.23 161.38 5.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 169.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -109.02 118.02 35.72 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -169.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 . . . . . 0 CA--C 1.541 0.603 0 C-N-CA 123.798 0.839 . . . . 0.0 109.65 174.26 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 N--CA 1.455 -0.779 0 N-CA-C 110.204 -0.729 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 30.6 mm -85.9 135.43 25.01 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -110.04 -16.35 13.83 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.379 -1.296 . . . . 0.0 111.069 172.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 40.7 tp -147.79 135.04 20.53 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 120.409 1.459 . . . . 0.0 110.429 -169.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.7 mp -138.99 136.99 35.96 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.307 1.043 . . . . 0.0 109.061 -172.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 4.0 mt -116.72 115.42 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.051 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 168.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.81 152.52 40.83 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 171.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.32 137.83 27.45 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 104.856 -2.276 . . . . 0.0 104.856 169.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 92.1 p -129.99 148.03 51.8 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.047 1.739 . . . . 0.0 107.412 169.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.84 136.6 23.13 Favored 'General case' 0 CA--C 1.513 -0.474 0 O-C-N 121.625 -0.672 . . . . 0.0 109.671 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.22 -21.35 60.66 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 123.525 0.515 . . . . 0.0 111.628 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -143.92 153.0 41.84 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.863 0.865 . . . . 0.0 109.738 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.43 -33.37 71.17 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -77.61 -31.04 52.64 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.306 0.957 . . . . 0.0 111.236 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.5 m -63.53 -37.99 89.42 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.901 -0.499 . . . . 0.0 109.701 169.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -47.7 84.37 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.191 0.996 . . . . 0.0 110.219 171.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.0 mm -58.38 -50.62 78.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.03 -39.2 93.99 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-N 119.115 0.871 . . . . 0.0 111.93 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.12 -52.66 32.31 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.567 1.147 . . . . 0.0 110.567 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.0 mm -50.81 -47.34 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 125.508 1.523 . . . . 0.0 108.671 173.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -66.55 -9.45 35.1 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.974 -1.079 . . . . 0.0 112.542 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -93.87 -48.5 6.25 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 124.204 1.002 . . . . 0.0 109.626 169.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.1 pp -72.39 -24.38 61.24 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 113.313 0.856 . . . . 0.0 113.313 -173.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.3 p -66.11 -21.69 66.36 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 123.124 0.57 . . . . 0.0 111.457 172.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -67.0 -21.25 65.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.246 0.93 . . . . 0.0 109.849 172.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 24.8 mt -96.82 -71.21 0.69 Allowed 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.12 0.968 . . . . 0.0 110.783 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 20.0 mt -69.06 -13.33 62.38 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 -169.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 31.2 m -100.22 27.26 5.77 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 120.243 1.383 . . . . 0.0 111.522 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -128.88 110.46 12.14 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.625 1.97 . . . . 0.0 106.104 172.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -60.24 -26.63 66.59 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.863 0.465 . . . . 0.0 111.453 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -62.93 -47.49 82.99 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 123.619 0.768 . . . . 0.0 109.676 175.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -65.52 -44.16 94.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 123.982 0.913 . . . . 0.0 109.092 176.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 48.2 mt -56.12 -43.39 78.12 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 118.632 0.651 . . . . 0.0 111.487 -175.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -67.74 -40.47 84.15 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 118.052 0.387 . . . . 0.0 110.462 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -69.64 -33.08 72.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 118.749 0.704 . . . . 0.0 110.214 -176.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 19.1 mt -68.3 -56.77 7.43 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 170.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 35.7 mt -55.41 -26.22 40.47 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -173.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 74.4 p -101.57 6.78 42.31 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.402 1.081 . . . . 0.0 112.338 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.31 112.7 1.65 Allowed 'General case' 0 C--N 1.342 0.264 0 C-N-CA 124.845 1.258 . . . . 0.0 110.493 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 7.4 m -70.0 -24.81 63.36 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.253 0.621 . . . . 0.0 112.054 177.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 15.5 m -150.59 158.97 44.77 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.111 0.964 . . . . 0.0 110.16 -169.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -51.15 -39.34 56.08 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.949 1.7 . . . . 0.0 111.1 176.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -57.25 -35.36 69.63 Favored 'General case' 0 C--O 1.227 -0.103 0 C-N-CA 123.13 0.572 . . . . 0.0 112.384 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -80.44 -27.71 37.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 119.426 1.012 . . . . 0.0 110.413 -177.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 27.4 mt -66.15 -50.44 63.93 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.526 1.057 . . . . 0.0 108.387 170.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.12 -33.75 67.68 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.934 0.894 . . . . 0.0 113.15 174.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.76 -42.53 99.73 Favored 'General case' 0 N--CA 1.463 0.177 0 O-C-N 121.209 -0.932 . . . . 0.0 110.868 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 96.6 mt -69.15 -35.41 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -179.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.1 mm -58.26 -53.82 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 169.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 24.7 m -63.96 -27.0 68.84 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 122.68 0.392 . . . . 0.0 111.578 -170.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -59.82 -27.38 66.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.663 1.585 . . . . 0.0 113.404 175.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.851 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 -174.64 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.486 1.354 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -67.05 112.39 4.36 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 104.873 -2.269 . . . . 0.0 104.873 168.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -48.53 -43.51 35.43 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.983 0.913 . . . . 0.0 110.377 -176.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.42 -24.36 1.94 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.685 1.994 . . . . 0.0 113.902 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -59.42 -26.85 65.51 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.291 0.951 . . . . 0.0 112.337 177.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -100.44 -15.86 17.77 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.098 0.959 . . . . 0.0 112.902 -174.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -103.09 98.32 11.52 Favored Pre-proline 0 N--CA 1.471 0.624 0 CA-C-N 120.879 1.672 . . . . 0.0 106.985 -173.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.5 -60.43 0.31 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.696 2.264 . . . . 0.0 113.434 -171.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.479 ' C ' ' H ' ' A' ' 11' ' ' SER . 54.9 tt0 -165.97 -87.02 0.02 OUTLIER 'General case' 0 C--O 1.232 0.157 0 C-N-CA 123.592 0.757 . . . . 0.0 111.621 -170.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.2 m -67.87 8.76 0.35 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.337 1.455 . . . . 0.0 111.754 176.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.479 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -65.63 -25.54 67.42 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.99 1.316 . . . . 0.0 111.905 -174.926 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.2 mp -98.23 140.0 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.975 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.0 m -154.39 158.36 39.91 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.483 0.659 . . . . 0.0 110.606 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.5 t -128.33 145.46 35.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 173.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mm -138.76 140.04 39.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 104.654 -2.351 . . . . 0.0 104.654 -169.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -71.34 -49.52 41.63 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 119.269 0.941 . . . . 0.0 109.303 171.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.0 p -159.4 144.24 15.48 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.5 156.87 25.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 169.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.7 ttpt -58.75 -42.07 87.99 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.878 0.471 . . . . 0.0 110.653 175.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -165.22 177.69 7.46 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 128.212 2.605 . . . . 0.0 107.214 173.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.81 -37.07 65.65 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.227 1.811 . . . . 0.0 114.036 175.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -62.6 -50.35 71.6 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 120.401 1.455 . . . . 0.0 108.687 173.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -60.55 -32.45 71.52 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 122.951 0.5 . . . . 0.0 111.416 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.36 -37.86 86.27 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 121.575 -0.703 . . . . 0.0 110.158 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.51 -47.28 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 170.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -58.03 -49.64 76.15 Favored 'General case' 0 C--N 1.334 -0.082 0 C-N-CA 123.222 0.609 . . . . 0.0 110.657 -174.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -62.82 -28.69 70.18 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.568 1.147 . . . . 0.0 111.626 174.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.2 m -76.51 -15.18 59.94 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.718 1.145 . . . . 0.0 112.766 177.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.94 -12.49 4.7 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -171.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -55.75 -34.19 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 120.525 1.511 . . . . 0.0 112.069 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.9 m -66.84 -41.61 87.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.385 -0.822 . . . . 0.0 110.253 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -65.74 -38.45 89.15 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 46.2 tp -60.65 -49.86 75.82 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.534 0.734 . . . . 0.0 110.316 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -64.92 -33.2 75.45 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.398 1.079 . . . . 0.0 112.221 -176.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -79.86 -0.37 34.47 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.654 1.182 . . . . 0.0 111.876 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 53.82 32.07 14.29 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.24 1.816 . . . . 0.0 113.284 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -68.31 -24.88 64.89 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 120.819 -1.175 . . . . 0.0 109.709 168.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.6 pt -144.07 168.72 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 126.235 1.814 . . . . 0.0 110.016 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.3 p -96.11 172.56 7.91 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.807 1.243 . . . . 0.0 109.845 169.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.27 -33.05 74.49 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.267 -0.896 . . . . 0.0 110.557 171.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -61.27 -40.25 93.41 Favored 'General case' 0 C--N 1.342 0.251 0 O-C-N 121.97 -0.456 . . . . 0.0 110.684 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -54.28 -49.48 69.49 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.009 0.524 . . . . 0.0 110.154 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 45.2 mt -59.72 -49.2 84.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 C-N-CA 123.644 0.778 . . . . 0.0 109.246 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -68.5 -26.87 65.68 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.165 -0.921 . . . . 0.0 111.995 -174.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.95 83.29 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.566 1.076 . . . . 0.0 110.683 171.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.06 -51.72 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -58.52 -44.03 89.36 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -175.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -64.28 -46.24 84.54 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.774 0.83 . . . . 0.0 111.275 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.0 m -64.05 -35.79 81.88 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.801 0.44 . . . . 0.0 110.76 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 96.8 m . . . . . 0 N--CA 1.449 -0.495 0 C-N-CA 123.746 0.818 . . . . 0.0 109.827 177.891 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 . . . . . 0 N--CA 1.452 -0.328 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 26.3 mm -137.04 140.03 43.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 102.643 -3.095 . . . . 0.0 102.643 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.7 mt -110.39 -40.46 4.64 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -168.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -168.38 165.03 7.82 Favored Pre-proline 0 C--O 1.236 0.384 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -169.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -47.92 113.03 0.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.827 2.351 . . . . 0.0 110.756 169.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.16 5.78 75.99 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 117.81 -1.55 . . . . 0.0 114.848 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 19.0 t -135.3 133.95 52.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-N 120.92 2.36 . . . . 0.0 109.524 -171.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.65 166.77 21.84 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.786 1.635 . . . . 0.0 110.281 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 33.5 ttp -147.5 82.44 8.13 Favored Pre-proline 0 C--O 1.225 -0.195 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 170.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -58.76 -91.21 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.312 0 C-N-CA 123.036 2.491 . . . . 0.0 114.43 -174.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . 0.301 0.2 OUTLIER 47.78 178.18 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.578 2.351 . . . . 0.0 114.753 -168.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.7 167.94 19.92 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 125.281 1.432 . . . . 0.0 107.848 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 25.1 mtm105 -60.74 150.57 75.61 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-O 118.575 -0.726 . . . . 0.0 109.046 174.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -45.63 -45.14 16.73 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.634 2.889 . . . . 0.0 112.755 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -61.71 -15.55 41.48 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.219 1.408 . . . . 0.0 113.643 -176.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.5 m -79.63 -4.72 52.91 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.518 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 131.49 18.64 1.27 Allowed Glycine 0 CA--C 1.523 0.579 0 CA-C-O 118.943 -0.92 . . . . 0.0 113.591 174.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.0 144.2 56.34 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 119.087 1.443 . . . . 0.0 107.645 169.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.9 mt -123.69 -32.63 3.3 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 124.313 1.045 . . . . 0.0 110.158 -173.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -143.19 170.85 14.97 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.415 1.886 . . . . 0.0 107.468 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 97.5 m -103.17 122.23 44.28 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.464 0.706 . . . . 0.0 110.381 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.11 -177.23 38.65 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 126.017 1.77 . . . . 0.0 111.052 -175.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 51.4 mtt -149.15 169.83 19.82 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.594 1.697 . . . . 0.0 112.065 -171.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.9 p -146.86 168.08 22.32 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.859 1.264 . . . . 0.0 109.793 174.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.5 tp -153.98 106.78 2.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.797 1.639 . . . . 0.0 106.795 -172.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 65.5 m -122.7 140.9 52.36 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 123.79 0.836 . . . . 0.0 108.77 -169.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.4 tt -133.67 130.47 38.26 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.3 mp -110.32 119.45 39.28 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.744 1.617 . . . . 0.0 107.924 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -63.1 -36.15 82.62 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.588 0.631 . . . . 0.0 112.178 -177.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -91.05 -17.1 26.79 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.811 1.245 . . . . 0.0 111.919 177.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 68.1 -179.93 18.18 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -168.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.74 162.94 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 169.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -121.09 83.82 2.14 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 122.295 1.045 . . . . 0.0 110.605 -169.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 CA--C 1.538 0.507 0 CA-C-N 114.317 -1.31 . . . . 0.0 112.212 174.142 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo . . . . . 0 N--CA 1.456 -0.715 0 CA-C-O 121.546 0.561 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 47.5 mm -112.43 136.95 47.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 C-N-CA 124.735 1.214 . . . . 0.0 107.876 -171.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -113.74 -9.71 13.12 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 117.192 -1.385 . . . . 0.0 110.973 175.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.9 mt -136.37 138.94 42.12 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 120.582 1.537 . . . . 0.0 111.309 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.5 mp -137.02 101.46 4.57 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.7 mp -77.05 146.43 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 169.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.06 23.68 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 109.035 -1.626 . . . . 0.0 109.035 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.1 tt -155.04 150.0 26.79 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 -171.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.0 p -143.0 141.95 31.48 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 127.226 2.211 . . . . 0.0 105.084 169.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -149.23 130.22 14.37 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -173.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.29 -22.96 57.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 123.399 0.437 . . . . 0.0 111.428 -175.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -139.41 155.76 47.42 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.778 0.831 . . . . 0.0 110.32 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.87 -34.24 71.4 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.684 0.793 . . . . 0.0 112.973 -177.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -77.28 -32.16 55.34 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.1 0.864 . . . . 0.0 111.102 177.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.3 m -60.48 -41.7 94.78 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 169.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.36 -47.3 84.24 Favored 'General case' 0 C--O 1.225 -0.21 0 C-N-CA 124.68 1.192 . . . . 0.0 110.71 173.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 15.1 mm -59.69 -53.03 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -63.14 -37.04 94.27 Favored Glycine 0 CA--C 1.528 0.891 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 -177.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.0 -50.77 63.11 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.641 1.177 . . . . 0.0 110.53 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 mm -54.71 -45.54 73.19 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.28 -10.32 59.56 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.674 0.79 . . . . 0.0 113.056 -177.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.23 -42.5 14.62 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 169.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 83.8 mt -63.77 -32.99 74.67 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 117.804 -1.093 . . . . 0.0 110.2 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 13.8 m -51.17 -28.88 12.23 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 171.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -67.9 -22.82 65.06 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.634 1.106 . . . . 0.0 110.845 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 49.6 mt -108.03 -60.81 1.67 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.744 1.218 . . . . 0.0 109.874 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.14 -38.73 58.48 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 127.679 2.392 . . . . 0.0 114.19 178.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 56.5 m -95.06 24.99 4.45 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.481 1.037 . . . . 0.0 111.664 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -133.32 101.91 5.35 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 124.101 0.96 . . . . 0.0 108.808 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -58.16 -28.55 64.83 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.801 -179.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.35 -43.15 91.75 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.278 0.631 . . . . 0.0 110.049 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.56 -44.4 86.44 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.8 mt -56.29 -37.88 70.47 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 119.101 0.864 . . . . 0.0 111.319 -176.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -68.35 -40.33 81.57 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 118.907 0.776 . . . . 0.0 111.109 175.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -69.03 -34.76 75.75 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 118.797 0.726 . . . . 0.0 109.805 -177.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -65.96 -55.15 18.3 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 169.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 35.0 mt -56.19 -16.11 4.79 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.901 1.075 . . . . 0.0 113.901 -176.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 42.8 p -112.0 7.62 19.91 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.95 1.3 . . . . 0.0 110.806 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.49 117.78 6.16 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.631 1.572 . . . . 0.0 110.348 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 19.8 m -76.99 -15.36 59.66 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.721 0.808 . . . . 0.0 112.157 175.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 73.5 p -154.92 164.65 38.56 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 119.035 0.834 . . . . 0.0 110.986 -170.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -58.09 -37.11 73.88 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.856 0.862 . . . . 0.0 109.494 169.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -57.91 -45.53 86.35 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 122.659 0.384 . . . . 0.0 110.455 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.68 -33.87 76.9 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.3 mt -67.55 -51.49 50.14 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.065 0.848 . . . . 0.0 109.074 175.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.72 -24.4 67.76 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.096 0.958 . . . . 0.0 113.511 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -61.07 -44.67 97.02 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 120.712 -1.243 . . . . 0.0 109.776 172.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 89.9 mt -67.35 -35.51 73.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.166 0.986 . . . . 0.0 109.368 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 41.2 mm -56.22 -53.77 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 169.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 20.3 m -64.66 -33.02 74.95 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 123.642 0.589 . . . . 0.0 110.624 -171.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -58.51 -45.06 89.55 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.779 1.631 . . . . 0.0 112.707 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.038 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 -169.785 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 tpt . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -65.91 110.11 2.76 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 168.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.38 -41.11 65.58 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.618 0.767 . . . . 0.0 110.447 -175.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.4 p -53.26 -21.62 5.68 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.583 1.553 . . . . 0.0 113.549 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -59.82 -25.0 64.61 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.664 1.12 . . . . 0.0 112.264 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -100.72 -10.97 20.33 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 117.57 -1.205 . . . . 0.0 113.126 -174.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -113.78 83.32 7.3 Favored Pre-proline 0 N--CA 1.474 0.768 0 CA-C-N 121.52 1.964 . . . . 0.0 107.479 -174.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -55.74 -54.18 4.53 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.864 3.042 . . . . 0.0 116.277 -169.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.529 ' C ' ' H ' ' A' ' 11' ' ' SER . 42.0 tt0 -157.88 -93.34 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.573 0.624 . . . . 0.0 112.589 -169.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 m -68.52 13.43 0.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.432 1.493 . . . . 0.0 111.365 177.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.529 ' H ' ' C ' ' A' ' 9' ' ' GLU . 11.2 m -62.03 -29.17 70.1 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.448 1.499 . . . . 0.0 111.229 -169.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.3 mp -105.84 129.93 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 -175.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 31.1 m -144.2 141.56 29.97 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 123.388 0.43 . . . . 0.0 110.351 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.4 t -112.6 135.41 52.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 169.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.421 HG23 ' H ' ' A' ' 17' ' ' SER . 30.9 mt -136.75 145.52 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -169.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.442 ' CE1' HE22 ' A' ' 86' ' ' GLN . 32.5 t-80 -59.4 -46.29 89.11 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.99 0.916 . . . . 0.0 111.82 174.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.421 ' H ' HG23 ' A' ' 15' ' ' ILE . 18.5 p -168.14 150.94 5.56 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.541 1.136 . . . . 0.0 108.161 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.21 144.26 30.8 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 168.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tppt? -72.32 -30.01 64.36 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 122.096 -0.378 . . . . 0.0 111.955 -175.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -163.81 173.18 13.1 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 127.388 2.275 . . . . 0.0 106.123 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -66.6 -33.95 76.8 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 119.252 -0.404 . . . . 0.0 110.504 169.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.404 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.4 mt-30 -59.06 -48.03 83.09 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 169.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -65.54 -33.56 76.21 Favored 'General case' 0 C--O 1.223 -0.292 0 O-C-N 121.788 -0.57 . . . . 0.0 111.52 -178.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.61 -37.77 88.6 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 121.81 -0.556 . . . . 0.0 109.686 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.1 -45.85 85.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -56.87 -44.95 82.75 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.035 0.534 . . . . 0.0 110.426 -174.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -67.62 -32.79 73.75 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 118.101 -0.952 . . . . 0.0 111.734 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.3 m -61.99 -21.16 64.61 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.64 1.109 . . . . 0.0 112.274 173.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.6 mmt -122.2 -23.94 5.2 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 -169.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -59.5 -34.57 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 120.912 1.687 . . . . 0.0 112.272 -170.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.1 m -63.1 -29.64 70.96 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.34 0.973 . . . . 0.0 111.723 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 71.5 mt -81.07 -40.66 23.8 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.153 0.981 . . . . 0.0 109.265 174.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.5 tp -56.58 -40.71 75.7 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.711 0.804 . . . . 0.0 110.628 177.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -66.54 -27.96 68.16 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 124.918 1.287 . . . . 0.0 113.068 -172.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -101.87 16.95 24.35 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 117.971 0.351 . . . . 0.0 110.486 173.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.423 0.0 OUTLIER 44.28 42.66 5.36 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.26 2.224 . . . . 0.0 115.807 -170.122 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -68.14 -19.29 64.81 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 120.974 -1.079 . . . . 0.0 110.193 168.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.9 pt -143.26 174.14 5.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 127.081 2.152 . . . . 0.0 108.125 -176.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 m -111.75 159.22 18.47 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.007 1.723 . . . . 0.0 107.722 171.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -60.99 -30.65 70.4 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.971 -1.08 . . . . 0.0 111.901 -176.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -57.97 -36.73 73.0 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.705 -0.622 . . . . 0.0 111.92 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -60.3 -45.11 94.51 Favored 'General case' 0 CA--C 1.527 0.09 0 C-N-CA 123.681 0.792 . . . . 0.0 110.015 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.8 mt -59.1 -51.05 77.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 124.725 1.21 . . . . 0.0 108.481 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.8 tp60 -67.97 -26.0 65.71 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.026 -0.988 . . . . 0.0 111.775 -175.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.33 -43.36 96.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 119.771 1.168 . . . . 0.0 110.658 173.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.2 mt -67.74 -48.81 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.404 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.4 mttt -59.34 -45.5 91.19 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.195 0.452 . . . . 0.0 109.841 -175.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.3 -42.78 96.21 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 124.222 1.009 . . . . 0.0 111.106 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.0 m -64.36 -42.9 95.97 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.135 0.425 . . . . 0.0 110.235 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 98.3 m . . . . . 0 CA--C 1.536 0.437 0 C-N-CA 124.573 1.149 . . . . 0.0 111.022 176.454 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.3 mm -125.65 127.02 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 103.713 -2.699 . . . . 0.0 103.713 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.9 mp -120.15 -21.99 6.8 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -169.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.56 159.36 31.72 Favored Pre-proline 0 C--O 1.236 0.368 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 170.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -62.24 104.83 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 121.682 1.588 . . . . 0.0 108.99 170.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.56 -10.04 16.68 Favored Glycine 0 CA--C 1.533 1.176 0 CA-C-O 117.958 -1.468 . . . . 0.0 113.973 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.8 t -132.91 123.06 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 119.632 1.716 . . . . 0.0 108.863 -170.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -117.73 167.17 11.61 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 126.114 1.766 . . . . 0.0 109.12 174.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.9 ttm -137.58 60.25 24.68 Favored Pre-proline 0 CA--C 1.548 0.888 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 177.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -53.53 141.79 61.63 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.262 1.975 . . . . 0.0 114.429 -172.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -175.75 156.66 1.88 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.552 2.741 . . . . 0.0 106.753 -171.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.62 162.03 33.86 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.863 1.665 . . . . 0.0 107.366 169.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -52.52 141.94 32.62 Favored Pre-proline 0 CA--C 1.537 0.454 0 CA-C-O 117.676 -1.154 . . . . 0.0 108.868 176.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -45.69 -41.13 19.29 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.818 3.012 . . . . 0.0 112.916 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -62.2 -13.06 23.73 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.465 1.506 . . . . 0.0 113.253 -177.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 62.1 m -78.25 -1.82 34.85 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.649 0.78 . . . . 0.0 111.583 177.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.41 17.46 2.4 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-O 118.433 -1.204 . . . . 0.0 112.96 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.58 145.83 55.58 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.3 1.55 . . . . 0.0 108.724 169.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.1 mt -128.46 -32.28 2.2 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 124.471 1.109 . . . . 0.0 110.425 -173.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -145.26 160.86 40.84 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.605 1.562 . . . . 0.0 108.438 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 82.2 m -94.54 127.76 40.7 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 123.195 0.598 . . . . 0.0 110.091 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -170.82 -176.45 40.12 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 125.204 1.383 . . . . 0.0 110.683 -175.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 49.2 mtt -148.26 171.81 15.36 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.095 1.758 . . . . 0.0 111.059 -174.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -139.15 168.25 20.25 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.131 1.773 . . . . 0.0 108.586 174.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.3 tp -148.77 83.31 1.46 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.699 2.0 . . . . 0.0 107.397 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 55.7 m -86.51 142.57 28.25 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 176.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.2 tt -136.59 116.9 13.58 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 169.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -89.1 132.24 34.89 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 172.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.06 -29.24 70.12 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 169.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.442 HE22 ' CE1' ' A' ' 16' ' ' HIS . 32.1 mt-30 -130.29 75.66 1.67 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.645 1.978 . . . . 0.0 107.331 -178.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -52.12 161.45 2.17 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 125.949 1.738 . . . . 0.0 113.835 175.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 48.9 t -127.6 147.58 32.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 C-N-CA 125.745 1.618 . . . . 0.0 107.426 -173.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -98.65 179.14 4.77 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 . . . . . 0 C--N 1.323 -0.558 0 C-N-CA 124.162 0.985 . . . . 0.0 111.744 -169.664 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo . . . . . 0 N--CA 1.448 -1.17 0 N-CA-C 110.493 -0.618 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 49.6 mm -117.35 124.72 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -88.86 -33.34 17.38 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 117.178 -1.391 . . . . 0.0 109.434 169.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 mt -116.19 131.11 57.04 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-N 120.034 1.288 . . . . 0.0 112.025 -169.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mp -136.84 104.99 5.66 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.9 mp -87.51 112.34 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 175.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.18 153.88 47.15 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 172.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.27 133.97 19.97 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 169.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 93.0 p -127.62 147.69 50.36 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 126.344 1.858 . . . . 0.0 106.925 168.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -147.25 132.87 18.79 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -178.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.16 -22.74 60.44 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.721 0.408 . . . . 0.0 111.962 179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -144.42 155.82 43.93 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.678 0.791 . . . . 0.0 110.036 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.36 74.87 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.22 -31.22 62.53 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 120.839 -1.163 . . . . 0.0 111.032 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.7 m -64.65 -39.05 93.01 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.937 -0.477 . . . . 0.0 110.136 170.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -58.84 -48.84 79.92 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 123.637 0.775 . . . . 0.0 109.873 172.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 16.0 mm -55.92 -53.83 33.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.25 -39.28 94.39 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 118.837 0.744 . . . . 0.0 112.03 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.96 -53.3 27.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.459 1.104 . . . . 0.0 110.582 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -51.35 -47.44 34.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.47 1.508 . . . . 0.0 108.637 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -67.62 -10.66 54.13 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.499 1.12 . . . . 0.0 112.555 -177.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -93.87 -46.17 7.31 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 123.973 0.909 . . . . 0.0 109.726 169.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.8 pp -72.66 -25.24 61.19 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 118.711 0.687 . . . . 0.0 112.108 -173.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.9 p -61.18 -20.91 63.29 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.177 0.591 . . . . 0.0 112.152 172.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -65.7 -19.17 65.8 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.391 0.996 . . . . 0.0 110.098 172.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 36.5 mt -106.54 -63.29 1.29 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.639 1.576 . . . . 0.0 110.178 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.5 -23.85 59.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.533 1.933 . . . . 0.0 114.528 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.0 m -112.48 28.15 9.03 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 118.95 0.796 . . . . 0.0 110.165 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -132.89 102.57 5.69 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.863 0.865 . . . . 0.0 108.903 177.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -57.85 -26.92 62.72 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.938 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -62.09 -45.0 95.45 Favored 'General case' 0 C--N 1.34 0.152 0 C-N-CA 123.893 0.877 . . . . 0.0 110.123 174.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -69.06 -46.35 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 CA-C-O 117.961 -1.019 . . . . 0.0 108.728 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 8.8 mp -50.56 -44.18 56.57 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 119.541 1.064 . . . . 0.0 112.672 -176.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -71.25 -34.38 70.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 118.63 0.65 . . . . 0.0 110.384 -178.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -72.76 -34.43 67.0 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 121.404 -0.81 . . . . 0.0 109.68 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 55.7 mt -65.6 -53.47 41.27 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.9 mt -56.78 -32.43 65.64 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -174.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 37.2 p -88.24 -0.53 57.22 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.076 0.95 . . . . 0.0 112.26 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.87 138.64 57.22 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 119.127 0.876 . . . . 0.0 110.178 176.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.0 m -124.57 9.07 8.35 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.943 1.297 . . . . 0.0 110.754 176.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 74.8 p -152.16 153.66 34.31 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.491 1.116 . . . . 0.0 108.916 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -62.21 -32.12 72.74 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -58.07 -40.99 82.42 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.191 0.597 . . . . 0.0 111.842 176.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 14.3 tp60 -74.56 -30.89 61.91 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 119.429 1.013 . . . . 0.0 110.738 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.77 -50.15 52.82 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.407 1.003 . . . . 0.0 108.924 173.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.36 -31.1 65.41 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.515 1.126 . . . . 0.0 112.892 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -61.93 -45.85 91.88 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 120.842 -1.161 . . . . 0.0 110.038 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 95.7 mt -65.49 -37.2 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 123.987 0.915 . . . . 0.0 109.739 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 40.2 mm -56.24 -49.56 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-N 118.23 0.468 . . . . 0.0 110.128 169.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 39.2 m -66.84 -26.26 66.83 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -169.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -67.41 -34.86 78.11 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.776 0.717 . . . . 0.0 111.252 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.926 0 CA-C-O 117.815 -1.547 . . . . 0.0 110.375 -169.257 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tpp . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.705 0.288 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.34 106.45 1.71 Allowed 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 169.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.4 -42.9 96.88 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 175.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -56.03 -24.04 36.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.41 1.084 . . . . 0.0 112.773 -178.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.81 -22.68 66.8 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.097 0.862 . . . . 0.0 112.688 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -106.0 -10.2 16.69 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-O 116.52 -1.705 . . . . 0.0 113.593 -170.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -115.47 91.01 27.34 Favored Pre-proline 0 N--CA 1.477 0.925 0 CA-C-N 122.729 2.513 . . . . 0.0 108.433 -174.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -42.07 -75.07 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.804 1 C-N-CA 125.537 4.158 . . . . 0.0 116.795 -171.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.514 ' C ' ' H ' ' A' ' 11' ' ' SER . 8.0 tp10 -162.09 -76.69 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 124.032 0.933 . . . . 0.0 111.114 -173.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.1 m -66.86 6.35 0.51 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.544 1.537 . . . . 0.0 111.803 175.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.514 ' H ' ' C ' ' A' ' 9' ' ' GLU . 3.8 m -74.91 1.52 12.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 128.452 2.701 . . . . 0.0 113.247 -169.04 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.5 mt -130.69 131.82 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 -172.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.5 p -151.61 155.6 38.73 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 122.052 0.929 . . . . 0.0 111.347 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -127.59 136.1 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 103.297 -2.853 . . . . 0.0 103.297 169.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.1 mt -134.89 147.39 29.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 106.46 -1.682 . . . . 0.0 106.46 -169.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -63.24 -47.93 80.37 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.938 -0.476 . . . . 0.0 110.631 174.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 p -166.51 147.42 6.23 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -172.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.15 149.89 30.39 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 169.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -60.19 -41.03 92.07 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.02 0.528 . . . . 0.0 110.818 178.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -166.02 179.9 5.55 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 127.09 2.156 . . . . 0.0 107.658 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -64.61 -31.6 72.89 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.021 0.929 . . . . 0.0 112.567 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.411 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.2 mt-30 -62.95 -49.43 74.76 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 120.265 1.393 . . . . 0.0 107.872 169.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.47 -34.77 74.51 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 121.887 -0.508 . . . . 0.0 111.67 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.63 -35.52 79.85 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.936 -0.478 . . . . 0.0 110.124 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -71.27 -45.85 68.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 172.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -55.58 -44.71 77.17 Favored 'General case' 0 C--O 1.225 -0.203 0 O-C-N 121.747 -0.596 . . . . 0.0 110.8 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -65.76 -33.35 75.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.753 174.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.5 m -63.32 -19.91 65.03 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.638 1.108 . . . . 0.0 112.479 172.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.8 mmt -124.68 -20.97 4.92 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -168.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -59.66 -36.99 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 120.788 1.631 . . . . 0.0 111.916 -169.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.3 m -66.57 -19.79 65.86 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.941 0.791 . . . . 0.0 112.183 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.9 mt -86.03 -44.44 12.3 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 123.927 0.891 . . . . 0.0 109.072 170.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -56.38 -42.92 78.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.959 0.904 . . . . 0.0 110.772 -178.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -67.59 -23.03 65.34 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 125.758 1.623 . . . . 0.0 113.942 -170.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -115.38 26.44 10.07 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 122.558 0.343 . . . . 0.0 110.454 171.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 60.89 27.15 17.0 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 170.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -67.21 -22.15 65.73 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.133 -0.979 . . . . 0.0 110.814 169.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 pt -143.35 170.27 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 126.165 1.786 . . . . 0.0 108.879 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.6 m -102.63 158.79 15.99 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.304 1.841 . . . . 0.0 108.385 171.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.29 -32.43 70.03 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.227 -0.92 . . . . 0.0 112.372 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -58.23 -32.83 68.7 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.764 -0.585 . . . . 0.0 111.954 175.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -60.74 -42.65 97.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.586 0.754 . . . . 0.0 110.435 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -59.69 -50.8 78.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.3 tp60 -69.11 -27.58 65.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.59 -0.719 . . . . 0.0 111.915 -173.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.17 -40.98 78.39 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.016 0.826 . . . . 0.0 110.757 174.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.5 mt -72.6 -49.23 42.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.411 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 90.8 mttt -58.36 -41.24 84.27 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 119.448 -0.31 . . . . 0.0 110.443 -175.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -59.39 -52.74 64.32 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.463 0.705 . . . . 0.0 111.051 -173.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.5 m -64.64 -40.69 95.91 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.789 0.436 . . . . 0.0 110.481 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 CA--C 1.535 0.375 0 CA-C-O 119.098 -0.477 . . . . 0.0 111.671 178.273 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 . . . . . 0 N--CA 1.456 -0.151 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 50.2 mm -119.66 139.0 48.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 177.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mp -130.77 -25.18 2.35 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -169.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -158.5 161.86 27.74 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 173.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -48.64 118.38 3.34 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.775 2.317 . . . . 0.0 110.807 169.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.98 3.19 88.0 Favored Glycine 0 CA--C 1.533 1.199 0 CA-C-O 117.799 -1.556 . . . . 0.0 114.931 178.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 26.2 t -132.03 126.19 56.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-N 120.067 1.934 . . . . 0.0 108.882 -172.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.07 168.38 15.43 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.155 1.782 . . . . 0.0 109.768 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.4 ttm -137.31 60.41 26.97 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.035 0.934 . . . . 0.0 110.397 175.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -57.13 123.57 14.14 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 121.911 1.741 . . . . 0.0 110.362 -174.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.54 161.41 3.27 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.546 2.338 . . . . 0.0 106.855 -169.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -136.43 173.67 11.46 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.99 1.316 . . . . 0.0 109.343 -173.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 67.3 mtp85 -59.04 154.71 37.73 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 118.702 -0.666 . . . . 0.0 109.608 172.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.13 -39.59 84.08 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.204 1.936 . . . . 0.0 109.517 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -64.12 -12.92 44.12 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.558 1.543 . . . . 0.0 113.196 -177.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 73.6 m -77.17 -3.24 38.5 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.079 0.854 . . . . 0.0 111.784 177.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.85 19.6 1.98 Allowed Glycine 0 C--N 1.336 0.568 0 CA-C-O 118.245 -1.308 . . . . 0.0 112.689 173.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.75 145.32 56.13 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 119.502 1.651 . . . . 0.0 108.984 169.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -130.34 -30.57 1.92 Allowed 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 124.0 0.92 . . . . 0.0 111.047 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 mttt -148.04 155.6 41.68 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.939 1.296 . . . . 0.0 107.93 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 89.8 m -87.37 130.65 34.56 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 122.957 0.503 . . . . 0.0 111.592 -176.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -177.04 -177.98 46.4 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 125.173 1.368 . . . . 0.0 110.82 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 13.3 mtm -149.99 171.83 16.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 127.195 2.198 . . . . 0.0 109.731 -176.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.2 m -151.09 167.95 26.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.705 1.202 . . . . 0.0 109.273 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.7 tp -144.94 98.87 3.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 126.445 1.898 . . . . 0.0 108.468 -169.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 28.1 m -103.97 143.47 32.83 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.408 1.083 . . . . 0.0 108.69 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.4 tt -133.84 134.29 42.61 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 171.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -103.24 133.82 47.69 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.045 0.938 . . . . 0.0 108.653 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -67.62 -29.61 68.98 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 168.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -130.71 82.53 2.06 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 127.099 2.16 . . . . 0.0 106.796 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -46.98 157.61 0.53 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 113.083 -1.871 . . . . 0.0 113.743 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 95.5 t -123.8 150.68 28.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 -174.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -112.19 98.46 7.33 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.107 0.963 . . . . 0.0 110.663 -168.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 . . . . . 0 CA--C 1.538 0.492 0 C-N-CA 124.322 1.049 . . . . 0.0 110.827 169.928 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo . . . . . 0 CA--C 1.534 0.521 0 CA-C-O 120.863 0.276 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 25.5 mm -92.46 131.38 39.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 173.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -101.06 -19.31 15.86 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 116.351 -1.785 . . . . 0.0 110.923 169.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.7 mt -130.48 134.35 47.01 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 121.513 1.961 . . . . 0.0 111.887 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.7 mp -139.86 109.78 6.41 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -174.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.8 mp -92.34 119.23 39.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 175.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.36 153.03 34.9 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 170.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -151.38 143.55 24.01 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 170.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 79.4 p -142.73 146.31 34.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 168.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.463 ' HA ' ' HA ' ' A' ' 77' ' ' THR . . . -144.91 145.94 31.79 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 118.915 0.78 . . . . 0.0 109.716 170.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.69 -13.11 59.71 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.538 -0.465 . . . . 0.0 111.351 -176.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -137.04 151.26 48.72 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.63 0.772 . . . . 0.0 110.024 175.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.51 77.54 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -177.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -72.34 -30.03 64.37 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.119 -0.988 . . . . 0.0 110.946 176.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.0 m -66.94 -35.55 80.24 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.79 -0.569 . . . . 0.0 110.444 169.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 28.5 m-70 -62.19 -45.0 95.34 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.343 0.974 . . . . 0.0 109.85 170.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.1 mm -56.32 -52.03 56.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 118.946 0.794 . . . . 0.0 109.267 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.37 -39.69 95.08 Favored Glycine 0 CA--C 1.529 0.939 0 CA-C-N 118.945 0.793 . . . . 0.0 111.81 -177.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.86 67.46 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.411 0.684 . . . . 0.0 110.874 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.6 mm -58.04 -46.23 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 C-N-CA 124.607 1.163 . . . . 0.0 108.167 176.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -68.21 -12.04 60.29 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.139 -0.975 . . . . 0.0 111.527 -177.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.57 -48.58 6.54 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 124.276 1.031 . . . . 0.0 109.546 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 4.2 pp -68.83 -28.3 66.61 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.643 -177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.7 m -61.7 -20.21 63.22 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 118.822 -0.609 . . . . 0.0 112.393 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -67.19 -14.49 62.95 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.611 1.096 . . . . 0.0 110.734 171.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 32.6 mt -111.68 -59.51 1.97 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.683 1.593 . . . . 0.0 110.734 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.1 -37.25 74.16 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.669 1.188 . . . . 0.0 113.125 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 42.3 m -100.7 25.46 7.84 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.557 0.343 . . . . 0.0 110.679 -172.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -133.95 99.08 4.33 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 124.676 1.191 . . . . 0.0 108.121 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -57.04 -27.28 61.53 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.476 0.71 . . . . 0.0 112.309 -178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -64.0 -43.14 96.56 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.277 0.631 . . . . 0.0 110.065 175.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.3 mp -70.6 -42.83 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.2 mt -53.6 -40.43 65.68 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 119.247 0.93 . . . . 0.0 112.262 -175.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -71.56 -33.99 69.59 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 118.847 0.748 . . . . 0.0 110.569 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -72.31 -33.74 67.6 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 121.418 -0.801 . . . . 0.0 109.733 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -66.19 -53.92 31.5 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 26.8 mt -55.78 -30.22 60.95 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.136 0.574 . . . . 0.0 112.54 -174.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 32.1 p -91.56 2.86 56.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.273 1.029 . . . . 0.0 112.131 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.81 104.26 0.81 Allowed 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.465 1.106 . . . . 0.0 110.564 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 11.7 m -69.05 -26.61 65.05 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.37 0.668 . . . . 0.0 111.78 175.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.9 m -148.17 159.28 44.11 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.271 1.428 . . . . 0.0 108.954 -172.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -54.43 -31.66 55.8 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.36 1.464 . . . . 0.0 112.021 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -56.05 -34.46 65.92 Favored 'General case' 0 C--O 1.227 -0.083 0 C-N-CA 123.298 0.639 . . . . 0.0 112.616 -177.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -80.98 -26.47 36.51 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 119.451 1.023 . . . . 0.0 110.547 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 82.1 mt -71.07 -48.86 50.18 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 173.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -54.85 -38.55 67.6 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.893 1.277 . . . . 0.0 112.711 171.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -59.16 -47.73 84.24 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 118.941 0.791 . . . . 0.0 110.196 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 67.2 mt -65.91 -37.01 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 123.537 0.735 . . . . 0.0 110.292 -178.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 20.9 mm -57.32 -53.55 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 169.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 83.8 p -64.01 -29.5 70.65 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.129 0.49 . . . . 0.0 111.989 -169.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -57.93 -26.39 62.16 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.331 1.852 . . . . 0.0 113.342 176.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.876 0 N-CA-C 108.538 -1.825 . . . . 0.0 108.538 -177.684 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.3 tpt . . . . . 0 N--CA 1.488 1.433 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -67.15 114.56 6.0 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 169.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.32 -38.58 68.88 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 125.037 1.335 . . . . 0.0 110.038 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.86 -20.94 9.83 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.442 1.497 . . . . 0.0 112.891 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.84 -31.92 71.25 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 119.088 0.858 . . . . 0.0 112.508 175.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -87.08 -27.14 23.32 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 118.486 -0.768 . . . . 0.0 112.765 -171.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -91.42 104.31 9.66 Favored Pre-proline 0 CA--C 1.542 0.651 0 N-CA-C 103.801 -2.666 . . . . 0.0 103.801 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -63.46 -68.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.099 1.866 . . . . 0.0 113.686 -168.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -164.09 161.16 22.27 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.358 1.863 . . . . 0.0 106.38 171.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.0 m 53.07 22.87 2.7 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.34 1.056 . . . . 0.0 112.949 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.4 m -114.56 24.05 12.19 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 125.406 1.482 . . . . 0.0 110.691 -169.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.8 mt -131.52 129.69 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 103.863 -2.643 . . . . 0.0 103.863 178.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 m -150.38 149.24 29.8 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.475 0.71 . . . . 0.0 111.109 -173.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.7 t -123.65 142.61 39.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 169.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.6 mt -142.27 148.91 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 126.316 1.846 . . . . 0.0 106.168 -169.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -73.6 -46.58 46.23 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.553 -0.717 . . . . 0.0 109.911 172.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 p -163.21 144.47 9.57 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.54 158.61 33.44 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 169.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -58.18 -42.01 85.13 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.894 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -167.26 -177.43 3.66 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 127.931 2.492 . . . . 0.0 107.546 172.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -63.26 -33.18 74.95 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.462 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.6 mt-30 -60.29 -49.75 76.38 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 120.558 1.526 . . . . 0.0 107.433 173.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -61.88 -34.06 75.34 Favored 'General case' 0 C--O 1.221 -0.396 0 O-C-N 121.588 -0.695 . . . . 0.0 111.378 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.23 -32.01 71.91 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.658 -0.651 . . . . 0.0 111.262 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -46.4 82.84 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 171.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -56.51 -44.88 81.16 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.724 -0.61 . . . . 0.0 110.096 176.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -68.63 -13.92 62.68 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.216 -0.928 . . . . 0.0 113.083 174.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.5 m -82.96 -17.54 43.15 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.664 1.574 . . . . 0.0 111.592 169.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 3.3 mmt -130.35 -16.65 3.48 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -168.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.6 p -56.28 -37.02 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 120.173 1.351 . . . . 0.0 113.07 -169.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.2 m -68.33 -29.8 68.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.049 0.84 . . . . 0.0 111.645 -178.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 mt -75.91 -41.14 52.76 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 172.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.3 tp -58.46 -45.72 88.01 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.389 0.676 . . . . 0.0 110.568 179.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -60.15 -35.5 75.45 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.523 1.129 . . . . 0.0 112.118 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -96.54 17.25 16.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.738 -177.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.287 3.5 p30 43.06 38.17 1.39 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.941 1.696 . . . . 0.0 113.502 -176.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -73.21 -18.05 61.29 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 168.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.9 pt -145.98 166.95 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 127.113 2.165 . . . . 0.0 108.522 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 p -94.84 165.03 12.67 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.52 1.128 . . . . 0.0 109.24 169.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.99 -35.64 75.45 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.279 -0.888 . . . . 0.0 111.066 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.06 -21.33 66.37 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.205 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -62.0 -42.72 99.46 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.526 1.057 . . . . 0.0 110.0 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -58.86 -50.3 79.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 123.45 0.7 . . . . 0.0 109.207 175.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 32.2 tp60 -70.36 -24.76 63.02 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.924 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.42 -42.86 92.83 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.406 1.003 . . . . 0.0 110.252 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 74.5 mt -66.95 -47.15 83.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.462 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 93.2 mttt -60.72 -37.78 82.88 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.012 -177.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.53 -46.94 88.32 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 119.003 0.82 . . . . 0.0 111.301 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 46.2 m -68.48 -29.85 68.56 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.578 -0.701 . . . . 0.0 111.405 174.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 37.8 m . . . . . 0 CA--C 1.54 0.57 0 CA-C-N 118.279 0.491 . . . . 0.0 110.172 174.828 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 . . . . . 0 C--O 1.231 0.129 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.1 mm -140.4 138.48 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 177.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -123.27 -32.24 3.45 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.294 0.638 . . . . 0.0 111.692 -169.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.03 158.97 24.73 Favored Pre-proline 0 C--O 1.237 0.433 0 C-N-CA 126.927 2.091 . . . . 0.0 105.627 -175.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -60.0 117.04 3.74 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 121.505 1.47 . . . . 0.0 109.541 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 94.48 6.33 61.19 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.349 -1.25 . . . . 0.0 113.641 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.0 t -130.62 122.5 52.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 119.477 1.639 . . . . 0.0 108.197 -171.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.9 167.52 14.55 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.575 1.55 . . . . 0.0 109.461 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 12.8 ttm -143.38 66.81 16.23 Favored Pre-proline 0 C--N 1.331 -0.219 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -58.69 147.51 87.28 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 CA-C-O 122.472 0.947 . . . . 0.0 111.511 -173.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -179.54 155.02 0.65 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 128.365 2.666 . . . . 0.0 105.444 -169.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -133.9 153.74 51.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 169.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -54.45 145.14 39.49 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-O 117.685 -1.15 . . . . 0.0 109.377 -177.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -44.46 -44.91 13.21 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 123.818 3.012 . . . . 0.0 113.204 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.0 -14.51 48.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.617 1.567 . . . . 0.0 113.151 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 65.3 m -73.64 -25.24 60.19 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 118.613 0.642 . . . . 0.0 110.771 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 150.97 17.35 0.07 OUTLIER Glycine 0 C--N 1.337 0.609 0 CA-C-O 118.295 -1.28 . . . . 0.0 114.154 -178.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.22 152.54 44.94 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.142 1.471 . . . . 0.0 109.372 169.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.2 mt -131.65 -31.86 1.53 Allowed 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 124.128 0.971 . . . . 0.0 110.724 -175.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -146.68 158.24 43.87 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 125.628 1.571 . . . . 0.0 108.496 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.3 m -92.15 122.84 35.03 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.086 0.554 . . . . 0.0 110.184 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.07 -176.15 38.92 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.697 1.141 . . . . 0.0 111.02 -177.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 51.7 mtt -145.85 172.31 13.52 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.397 1.479 . . . . 0.0 110.64 -176.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 70.2 m -149.5 160.41 43.49 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.802 1.241 . . . . 0.0 109.06 169.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.4 tp -136.47 121.27 18.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.177 1.791 . . . . 0.0 108.892 -172.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 91.5 m -137.63 129.76 29.09 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -171.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.2 tp -122.89 139.1 54.4 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.8 mp -119.84 118.81 31.77 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 126.559 1.944 . . . . 0.0 106.433 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -60.12 -24.5 64.73 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.769 0.827 . . . . 0.0 113.007 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -115.58 -9.28 12.04 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.63 1.172 . . . . 0.0 111.946 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 61.17 -176.98 4.51 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 123.734 0.683 . . . . 0.0 112.119 -169.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -149.6 160.62 5.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 169.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -105.32 108.33 19.78 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.519 0.676 . . . . 0.0 110.96 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 . . . . . 0 N--CA 1.448 -0.532 0 C-N-CA 124.572 1.149 . . . . 0.0 108.396 170.133 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo . . . . . 0 N--CA 1.456 -0.681 0 N-CA-C 111.031 -0.411 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 22.1 mm -87.13 131.9 33.87 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt -103.88 -25.76 12.93 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.97 169.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -134.06 132.27 39.81 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 120.655 1.57 . . . . 0.0 109.966 -174.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -131.24 126.76 36.33 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -174.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.0 mt -109.84 103.59 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 169.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -66.6 146.8 49.05 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 169.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -143.0 138.07 29.76 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 104.907 -2.257 . . . . 0.0 104.907 169.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 94.9 p -131.34 147.95 52.62 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 126.139 1.775 . . . . 0.0 106.762 168.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -147.33 135.35 21.37 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.26 -21.52 58.5 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.753 0.421 . . . . 0.0 111.81 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -144.66 155.8 43.78 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.02 0.928 . . . . 0.0 109.825 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.18 -35.42 75.34 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.0 -31.05 62.78 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 120.894 -1.128 . . . . 0.0 111.064 176.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.8 m -64.8 -38.34 90.64 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.926 -0.484 . . . . 0.0 110.33 170.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -59.31 -49.72 76.76 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 123.521 0.729 . . . . 0.0 109.662 171.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.2 mm -55.37 -52.61 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.03 -39.72 96.07 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-N 119.098 0.863 . . . . 0.0 112.093 -177.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.85 -52.82 32.36 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.291 1.036 . . . . 0.0 110.635 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.9 mm -51.8 -47.86 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 C-N-CA 125.414 1.485 . . . . 0.0 108.571 174.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -67.45 -9.96 46.94 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 120.931 -1.106 . . . . 0.0 112.31 -177.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -91.46 -49.95 6.05 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 169.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.77 -22.84 62.34 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -173.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 33.7 m -62.95 -25.68 68.47 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.673 0.789 . . . . 0.0 111.135 172.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -66.75 -22.89 66.04 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.582 -0.699 . . . . 0.0 109.427 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 32.1 mt -95.04 -71.92 0.65 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.208 1.003 . . . . 0.0 110.621 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 22.5 mt -68.57 -16.47 63.87 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -169.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 32.1 m -97.28 27.75 4.02 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 120.176 1.353 . . . . 0.0 111.423 177.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -132.4 112.86 12.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.209 1.804 . . . . 0.0 106.388 173.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -61.89 -26.21 68.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.981 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -64.15 -42.87 96.59 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.006 0.523 . . . . 0.0 109.99 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.93 -43.21 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 123.689 0.796 . . . . 0.0 109.146 175.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 46.4 mt -55.02 -42.27 72.39 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 118.934 0.788 . . . . 0.0 111.095 -176.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -69.12 -36.5 77.56 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 118.579 -0.724 . . . . 0.0 111.015 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -65.21 -40.25 93.89 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 119.627 1.103 . . . . 0.0 108.951 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 24.6 mt -66.95 -52.6 40.97 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 176.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 54.9 mt -63.61 -9.0 11.42 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 61.1 p -122.7 10.48 9.66 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.688 1.195 . . . . 0.0 111.356 176.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.93 113.22 2.67 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 124.289 1.036 . . . . 0.0 109.72 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.5 m -74.63 -15.38 60.82 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.864 0.866 . . . . 0.0 112.212 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 85.8 p -153.05 163.09 40.48 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.894 0.854 . . . . 0.0 111.599 -173.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -58.04 -37.61 74.72 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.883 1.273 . . . . 0.0 109.494 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -60.67 -41.41 95.02 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 123.102 0.561 . . . . 0.0 110.945 175.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -65.38 -36.32 83.64 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 118.752 0.706 . . . . 0.0 112.138 176.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 36.4 mt -65.28 -46.93 78.47 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.641 1.11 . . . . 0.0 108.69 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.66 -32.97 67.83 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.921 0.888 . . . . 0.0 113.203 172.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -67.58 -40.52 84.84 Favored 'General case' 0 C--N 1.33 -0.243 0 O-C-N 121.103 -0.998 . . . . 0.0 110.412 177.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 71.1 mt -66.52 -36.76 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 123.777 0.831 . . . . 0.0 109.427 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.0 mm -58.61 -52.11 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 169.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 22.7 m -63.88 -27.78 69.39 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.259 0.224 . . . . 0.0 111.415 -173.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -60.09 -26.31 66.09 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.399 1.48 . . . . 0.0 113.104 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.867 0 N-CA-C 108.662 -1.775 . . . . 0.0 108.662 -178.643 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 tpp . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.4 mmm-85 -65.53 117.23 7.71 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 169.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.27 -44.92 94.91 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 177.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.3 p -56.36 -19.75 16.09 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.295 1.038 . . . . 0.0 113.187 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.25 -26.6 68.86 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.738 1.153 . . . . 0.0 112.338 174.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -96.87 -23.41 16.37 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 118.241 -0.885 . . . . 0.0 112.852 -172.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -101.81 101.55 18.76 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 120.298 1.408 . . . . 0.0 107.331 -173.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.55 -64.44 0.08 OUTLIER 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.378 2.719 . . . . 0.0 115.164 -169.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.482 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.9 tp10 -158.94 -77.68 0.07 Allowed 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.74 0.816 . . . . 0.0 111.908 -172.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.23 10.86 0.27 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.089 1.355 . . . . 0.0 111.502 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.482 ' H ' ' C ' ' A' ' 9' ' ' GLU . 1.8 p -79.27 12.09 2.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.149 2.18 . . . . 0.0 113.329 -169.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 mp -135.24 130.11 50.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 173.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.6 m -144.35 153.76 42.31 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.034 0.534 . . . . 0.0 110.866 175.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 74.1 t -122.81 142.23 40.14 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 106.182 -1.784 . . . . 0.0 106.182 170.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.4 mt -140.59 146.11 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 -170.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 48.8 m-70 -65.42 -51.94 56.8 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 174.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -159.0 147.63 18.3 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.06 149.84 37.42 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 171.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 tmmm? -58.2 -39.22 78.39 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.029 0.532 . . . . 0.0 109.788 177.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -161.67 175.93 11.5 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 126.465 1.906 . . . . 0.0 107.937 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -69.16 -33.69 73.8 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 123.364 0.665 . . . . 0.0 111.552 174.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -61.18 -41.82 97.48 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 119.858 1.208 . . . . 0.0 108.884 169.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -67.44 -32.89 74.06 Favored 'General case' 0 C--O 1.223 -0.319 0 O-C-N 121.606 -0.684 . . . . 0.0 111.561 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -34.83 78.94 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.946 0.498 . . . . 0.0 110.005 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.34 -46.79 80.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 169.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -55.12 -47.23 75.33 Favored 'General case' 0 C--O 1.226 -0.171 0 C-N-CA 122.954 0.501 . . . . 0.0 110.047 -176.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -66.28 -31.37 72.13 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.441 174.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.8 m -61.87 -22.49 65.58 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.918 1.235 . . . . 0.0 112.032 172.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.2 mmt -123.06 -17.51 6.67 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -169.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.34 -36.51 52.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 120.619 1.554 . . . . 0.0 113.019 -169.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.6 m -67.31 -31.76 72.27 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.989 0.813 . . . . 0.0 110.932 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 73.3 mt -73.49 -40.95 63.7 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.748 0.819 . . . . 0.0 109.106 173.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.0 tp -59.34 -44.61 92.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.455 0.702 . . . . 0.0 110.495 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -64.25 -42.51 96.48 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 124.222 1.009 . . . . 0.0 111.693 -176.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.3 13.7 3.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.98 1.312 . . . . 0.0 111.735 175.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.301 6.2 p30 44.51 37.47 2.13 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.68 1.992 . . . . 0.0 114.944 -176.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -69.9 -18.94 63.42 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.088 -1.008 . . . . 0.0 109.492 168.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.7 pt -145.86 168.33 7.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 126.736 2.014 . . . . 0.0 108.766 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 m -106.13 162.02 14.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.775 1.63 . . . . 0.0 108.695 169.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -58.78 -36.88 75.15 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.172 -0.955 . . . . 0.0 112.28 -174.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -59.99 -24.08 64.16 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.893 0.877 . . . . 0.0 113.007 175.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -63.74 -46.16 86.59 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 119.485 1.039 . . . . 0.0 110.264 175.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.5 -47.92 90.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -66.94 -27.66 67.65 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 118.473 -0.775 . . . . 0.0 111.774 -175.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.35 74.33 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.323 0.965 . . . . 0.0 111.691 173.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 26.1 mt -76.12 -50.59 22.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -57.89 -44.68 86.86 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 -173.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.9 -50.69 71.2 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.377 0.671 . . . . 0.0 111.071 -172.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.5 m -66.2 -38.74 88.72 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 118.051 0.387 . . . . 0.0 110.744 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.1 m . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 123.137 0.575 . . . . 0.0 111.012 174.479 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 . . . . . 0 N--CA 1.457 -0.106 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.5 mm -124.29 136.64 59.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -122.25 -30.38 4.01 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.304 0.642 . . . . 0.0 111.666 -169.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.59 160.91 27.73 Favored Pre-proline 0 C--O 1.236 0.351 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -57.08 113.51 1.51 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 121.857 1.704 . . . . 0.0 108.959 169.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.22 -8.94 49.52 Favored Glycine 0 CA--C 1.531 1.088 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.187 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.2 t -129.48 125.1 61.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 CA-C-N 119.943 1.871 . . . . 0.0 109.831 -169.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -123.68 167.99 13.25 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 125.687 1.595 . . . . 0.0 109.684 175.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 ttm -141.86 62.27 14.22 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -49.58 142.3 24.41 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.417 2.078 . . . . 0.0 114.421 -175.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 179.93 153.7 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 128.754 2.822 . . . . 0.0 106.256 -171.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.92 159.26 42.01 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 125.741 1.616 . . . . 0.0 107.609 169.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 32.1 mtp-105 -51.16 142.66 18.37 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-O 117.707 -1.139 . . . . 0.0 109.203 177.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_exo -45.53 -42.02 18.38 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.716 2.944 . . . . 0.0 113.091 -178.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -61.31 -14.48 27.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.429 1.492 . . . . 0.0 113.336 -177.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.9 m -77.76 -9.27 58.92 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.588 0.755 . . . . 0.0 112.011 -178.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 137.12 17.28 0.71 Allowed Glycine 0 CA--C 1.527 0.82 0 CA-C-O 118.195 -1.336 . . . . 0.0 113.868 178.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.97 149.38 47.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.801 1.8 . . . . 0.0 109.463 169.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.2 mt -129.43 -35.86 1.72 Allowed 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.781 1.233 . . . . 0.0 110.146 -176.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -144.76 158.93 43.6 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.502 1.521 . . . . 0.0 108.49 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 76.1 m -90.97 127.25 36.34 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.147 0.579 . . . . 0.0 110.367 -178.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -170.98 -178.69 41.7 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.978 1.275 . . . . 0.0 110.836 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 37.9 mtt -145.44 170.36 16.53 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.675 1.59 . . . . 0.0 110.713 -177.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.8 m -152.79 171.5 18.16 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.355 1.462 . . . . 0.0 109.245 169.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.9 tp -143.81 128.86 18.6 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 127.052 2.141 . . . . 0.0 107.895 -169.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 90.5 m -130.46 143.14 50.57 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.057 1.343 . . . . 0.0 107.554 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.2 tp -134.17 143.33 47.83 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 171.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -113.3 137.73 51.06 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.591 1.156 . . . . 0.0 108.724 176.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -69.36 -40.98 77.15 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 168.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -118.92 96.35 5.21 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.964 2.106 . . . . 0.0 107.996 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -50.85 156.96 2.51 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.002 1.286 . . . . 0.0 112.942 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.1 t -118.84 152.78 21.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -113.85 93.95 4.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.899 0.879 . . . . 0.0 110.458 -167.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 . . . . . 0 CA--C 1.538 0.508 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.078 169.838 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo . . . . . 0 CA--C 1.531 0.353 0 N-CA-C 113.391 0.497 . . . . 0.0 113.391 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 39.9 mm -111.42 132.83 58.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -105.44 -15.4 15.03 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 117.347 -1.311 . . . . 0.0 110.973 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 46.4 tp -140.21 131.08 25.99 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 120.279 1.4 . . . . 0.0 109.979 -169.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.8 mp -137.53 138.87 40.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -176.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 3.7 mt -118.03 119.88 62.81 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 169.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.21 148.47 32.88 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.964 -1.654 . . . . 0.0 108.964 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -143.13 136.79 28.59 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 104.402 -2.444 . . . . 0.0 104.402 169.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.0 p -129.95 147.48 51.71 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 106.43 -1.692 . . . . 0.0 106.43 169.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.3 136.35 23.56 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 118.911 0.778 . . . . 0.0 109.244 -176.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.19 -22.63 55.1 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.804 0.442 . . . . 0.0 111.87 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -145.66 155.86 43.28 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.826 0.85 . . . . 0.0 109.984 -178.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.18 -34.97 74.33 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -75.09 -31.92 61.33 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 120.84 -1.162 . . . . 0.0 111.01 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.5 m -63.55 -40.59 97.39 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 122.095 -0.378 . . . . 0.0 110.025 169.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -58.28 -48.75 79.49 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.753 0.821 . . . . 0.0 110.104 172.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 11.1 mm -56.21 -53.63 37.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 123.472 0.709 . . . . 0.0 109.345 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.9 -39.05 96.39 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 118.822 0.737 . . . . 0.0 111.691 -176.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.61 -52.51 44.45 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.343 1.057 . . . . 0.0 110.451 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.5 mm -53.05 -47.32 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 C-N-CA 125.322 1.449 . . . . 0.0 108.791 176.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -66.96 -16.29 64.25 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.735 -0.603 . . . . 0.0 111.858 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -87.48 -46.38 9.65 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.695 0.798 . . . . 0.0 109.534 174.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.9 pp -71.17 -23.95 62.15 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.171 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 63.0 m -59.5 -23.4 62.75 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.4 0.68 . . . . 0.0 112.11 172.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -64.62 -20.92 66.56 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.164 0.893 . . . . 0.0 110.25 173.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 31.0 mt -106.59 -60.71 1.63 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.631 1.572 . . . . 0.0 111.095 -178.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.24 -31.55 69.18 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.916 1.286 . . . . 0.0 113.622 -177.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 60.5 m -101.67 26.97 6.78 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 118.681 0.673 . . . . 0.0 110.832 -175.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -139.94 93.21 2.62 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -170.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.1 -27.0 41.83 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.949 0.9 . . . . 0.0 112.756 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.95 -45.55 91.95 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 122.882 0.473 . . . . 0.0 110.034 176.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.5 mp -68.16 -45.34 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.907 0.883 . . . . 0.0 108.817 175.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 73.0 mt -54.78 -42.69 72.06 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 118.753 -0.642 . . . . 0.0 111.291 -174.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -67.05 -40.87 87.19 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 118.407 0.549 . . . . 0.0 110.601 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.19 -33.99 74.23 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 118.71 0.687 . . . . 0.0 110.124 -176.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 23.4 mt -69.74 -53.37 18.72 Favored 'General case' 0 C--O 1.224 -0.239 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 170.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 31.4 mt -57.41 -21.05 33.92 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -176.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 82.6 p -114.21 8.53 16.88 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.539 1.136 . . . . 0.0 111.181 -177.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.92 125.32 22.56 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.206 1.002 . . . . 0.0 110.244 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.9 m -85.27 -10.1 56.9 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.119 0.968 . . . . 0.0 111.683 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 71.9 p -154.4 159.19 40.97 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.903 0.774 . . . . 0.0 110.451 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -59.16 -33.51 71.01 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.175 0.59 . . . . 0.0 109.644 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -57.75 -39.27 76.96 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 118.967 -0.539 . . . . 0.0 111.236 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -66.32 -44.4 83.48 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.806 0.73 . . . . 0.0 111.671 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.02 -50.28 71.3 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.769 0.713 . . . . 0.0 109.135 178.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.01 -32.6 66.31 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.912 1.285 . . . . 0.0 113.381 173.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.12 -43.26 82.87 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 119.877 1.217 . . . . 0.0 110.054 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 88.9 mt -64.91 -36.43 77.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 123.732 0.813 . . . . 0.0 109.587 178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 29.8 mm -58.51 -52.28 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 33.8 m -66.77 -26.41 66.95 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.754 0.422 . . . . 0.0 111.385 -171.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -57.69 -28.85 64.18 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.868 1.667 . . . . 0.0 113.001 173.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.933 0 N-CA-C 109.002 -1.639 . . . . 0.0 109.002 -174.765 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 tpt . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -66.79 109.21 2.8 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 169.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -52.24 -42.08 63.32 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.211 0.604 . . . . 0.0 110.05 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.61 -22.47 13.55 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.853 1.661 . . . . 0.0 113.485 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -65.71 -26.85 67.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.153 0.888 . . . . 0.0 112.094 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -96.71 -19.08 19.23 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.189 -170.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -97.7 112.72 62.22 Favored Pre-proline 0 CA--C 1.546 0.809 0 CA-C-N 120.864 1.665 . . . . 0.0 108.75 -173.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.69 -173.22 0.09 OUTLIER 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 125.236 3.957 . . . . 0.0 114.711 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -72.99 145.61 46.58 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 171.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.1 m 50.08 24.36 1.38 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.359 1.464 . . . . 0.0 112.428 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 p -74.49 -9.04 58.2 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.444 -0.785 . . . . 0.0 112.357 -172.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.4 mp -115.49 136.94 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 C-N-CA 126.634 1.973 . . . . 0.0 107.048 -170.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.7 m -144.76 156.22 43.94 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.714 1.206 . . . . 0.0 110.335 -177.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.6 t -129.66 144.55 37.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 174.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mt -143.29 150.09 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 126.294 1.838 . . . . 0.0 106.539 -170.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -74.93 -48.2 25.8 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.565 -0.709 . . . . 0.0 109.883 171.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -159.95 144.19 14.6 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.184 -1.413 . . . . 0.0 107.184 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.17 162.12 24.87 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 169.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.3 tppt? -59.37 -43.75 92.83 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.033 0.533 . . . . 0.0 110.554 178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -167.17 -178.1 3.98 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 127.679 2.392 . . . . 0.0 107.758 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.5 p-90 -64.3 -32.7 74.41 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.463 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.4 mt-30 -59.31 -52.7 64.52 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.706 1.594 . . . . 0.0 107.381 172.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -60.05 -36.55 77.56 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 121.803 -0.56 . . . . 0.0 111.295 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.61 -30.14 71.16 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 118.833 -0.603 . . . . 0.0 111.09 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -69.09 -47.7 73.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 119.292 0.951 . . . . 0.0 108.548 172.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -55.68 -47.74 76.26 Favored 'General case' 0 C--O 1.227 -0.098 0 CA-C-N 118.315 0.507 . . . . 0.0 109.883 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -61.41 -33.59 73.96 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 117.928 -1.034 . . . . 0.0 111.974 174.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.1 m -64.83 -29.97 70.95 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 119.987 1.267 . . . . 0.0 112.428 175.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.6 mmm -115.95 -13.98 11.27 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -168.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -58.58 -33.85 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 120.299 1.409 . . . . 0.0 112.514 -169.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.7 p -65.78 -37.62 86.8 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.327 0.967 . . . . 0.0 110.652 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 77.7 mt -72.17 -37.81 69.26 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.587 0.755 . . . . 0.0 109.268 175.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.47 -44.23 96.1 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.685 0.675 . . . . 0.0 110.306 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -63.89 -45.09 90.91 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.878 1.271 . . . . 0.0 111.827 -176.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -80.44 12.52 2.96 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.282 1.033 . . . . 0.0 111.595 175.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.33 4.6 p30 43.54 43.21 4.46 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.821 2.049 . . . . 0.0 114.891 -176.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -75.96 -17.15 59.84 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 167.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.5 pt -145.26 173.82 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.653 1.981 . . . . 0.0 109.271 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.6 m -114.66 163.03 16.0 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.164 1.786 . . . . 0.0 109.267 169.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.21 -32.82 72.59 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.308 -0.87 . . . . 0.0 113.047 -170.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -58.23 -30.89 66.87 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.83 -0.544 . . . . 0.0 111.729 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -59.06 -46.59 87.86 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.391 0.676 . . . . 0.0 110.38 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.8 mp -56.73 -48.37 81.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 123.612 0.765 . . . . 0.0 109.001 176.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.5 tp60 -69.29 -26.24 64.64 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.264 -0.874 . . . . 0.0 112.027 -176.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.2 -39.37 93.84 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.828 1.195 . . . . 0.0 111.508 173.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 53.3 mt -66.5 -46.42 86.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.463 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.5 mttt -62.09 -42.4 99.18 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -178.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.18 -38.61 91.68 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 124.009 0.924 . . . . 0.0 111.407 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 m -62.93 -40.54 97.92 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.815 -0.553 . . . . 0.0 110.187 172.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 26.1 m . . . . . 0 CA--C 1.542 0.636 0 C-N-CA 123.762 0.825 . . . . 0.0 111.17 174.444 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 . . . . . 0 N--CA 1.454 -0.229 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.4 mm -135.67 131.96 50.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 -173.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -124.55 -24.41 4.21 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 123.805 0.691 . . . . 0.0 110.918 -172.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.53 165.28 19.07 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 124.689 1.196 . . . . 0.0 108.112 170.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -49.35 126.94 16.79 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.338 2.025 . . . . 0.0 110.062 169.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.39 1.82 77.19 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-O 117.88 -1.511 . . . . 0.0 115.48 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 77.8 t -131.01 117.31 37.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-N 120.322 2.061 . . . . 0.0 108.355 -173.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.17 163.57 16.87 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.687 1.595 . . . . 0.0 109.917 -177.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.7 ttm -134.14 60.68 46.1 Favored Pre-proline 0 CA--C 1.545 0.751 0 CA-C-O 118.998 -0.525 . . . . 0.0 112.096 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -54.06 147.82 42.03 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.345 2.03 . . . . 0.0 113.293 -172.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 175.6 157.52 0.21 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 128.726 2.811 . . . . 0.0 106.542 -168.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.39 159.12 42.85 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 126.137 1.775 . . . . 0.0 107.931 169.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -51.21 143.34 17.52 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-O 118.3 -0.857 . . . . 0.0 109.322 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -47.91 -42.07 31.81 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.079 2.519 . . . . 0.0 113.017 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -62.22 -13.34 26.9 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.873 1.269 . . . . 0.0 114.05 -177.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 72.2 m -77.39 -6.12 52.21 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.636 0.774 . . . . 0.0 111.897 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 132.91 18.03 1.12 Allowed Glycine 0 CA--C 1.524 0.655 0 CA-C-O 118.206 -1.33 . . . . 0.0 113.315 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.45 148.13 49.99 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.792 1.796 . . . . 0.0 108.986 169.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.6 mt -127.66 -35.19 2.14 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 124.827 1.251 . . . . 0.0 110.501 -175.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.8 mttp -142.4 158.83 43.28 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 125.707 1.603 . . . . 0.0 107.916 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.1 m -91.15 125.17 35.85 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 123.157 0.583 . . . . 0.0 109.709 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -171.94 179.79 43.38 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.672 1.13 . . . . 0.0 110.966 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 56.7 mtt -143.23 167.95 20.92 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 125.453 1.501 . . . . 0.0 110.154 -172.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.4 p -148.57 167.53 25.16 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.926 1.291 . . . . 0.0 108.346 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.1 tp -142.75 124.71 15.22 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.609 -0.682 . . . . 0.0 109.77 -176.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 64.9 m -131.77 133.49 44.81 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.5 tp -126.44 139.11 53.5 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 173.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.3 mp -119.31 123.27 43.81 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 105.296 -2.112 . . . . 0.0 105.296 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.1 -41.26 92.18 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.666 0.667 . . . . 0.0 111.532 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 -90.69 -16.7 28.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.383 1.073 . . . . 0.0 111.724 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.21 178.86 9.1 Favored Glycine 0 CA--C 1.534 1.272 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -168.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.07 156.88 15.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 168.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -102.87 99.29 9.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.908 0.861 . . . . 0.0 112.189 -168.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 . . . . . 0 CA--C 1.539 0.525 0 CA-C-N 114.332 -1.304 . . . . 0.0 108.484 169.441 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo . . . . . 0 N--CA 1.459 -0.539 0 CA-C-O 120.788 0.245 . . . . 0.0 112.116 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 27.9 mm -69.47 111.41 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 175.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -82.94 -29.53 29.05 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 116.743 -1.599 . . . . 0.0 110.409 169.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.8 tp -132.68 139.94 47.9 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 121.174 1.806 . . . . 0.0 112.126 -173.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.0 mp -134.6 103.27 5.6 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -178.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -83.17 118.1 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.142 0 N-CA-C 104.442 -2.429 . . . . 0.0 104.442 169.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.35 150.81 26.23 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 172.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.9 142.86 31.83 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 169.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 16.3 m -142.85 143.52 32.13 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 169.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.46 139.08 29.7 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 -169.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.39 -23.26 43.39 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.153 0.581 . . . . 0.0 111.92 -176.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -145.48 156.63 43.85 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.172 0.989 . . . . 0.0 109.809 -178.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.77 -34.75 73.4 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.178 0.806 . . . . 0.0 113.178 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -75.78 -32.34 59.86 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 120.936 -1.103 . . . . 0.0 111.062 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.2 m -62.32 -42.01 99.01 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 169.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 35.5 t60 -57.92 -49.09 77.94 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.034 0.933 . . . . 0.0 110.211 173.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 8.9 mm -56.21 -54.77 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 118.869 0.759 . . . . 0.0 109.444 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.24 -38.48 94.61 Favored Glycine 0 CA--C 1.531 1.035 0 CA-C-N 118.664 0.666 . . . . 0.0 111.71 -176.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.78 -49.48 58.31 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.493 1.117 . . . . 0.0 110.816 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.9 mm -55.94 -43.05 73.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 124.448 1.099 . . . . 0.0 108.989 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.3 mm-40 -70.49 -12.88 61.86 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.461 0.704 . . . . 0.0 112.061 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.26 -43.67 14.62 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 170.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.06 -27.71 64.86 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 121.864 -0.523 . . . . 0.0 111.759 -176.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 27.9 m -57.65 -21.87 42.39 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 171.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -74.89 -22.46 58.63 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.556 1.071 . . . . 0.0 111.058 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 49.2 mt -101.98 -62.22 1.29 Allowed 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 123.872 0.869 . . . . 0.0 110.639 -177.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.37 -13.24 58.16 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.402 1.481 . . . . 0.0 113.62 -173.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 37.3 m -117.81 29.86 7.59 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.039 0.836 . . . . 0.0 110.511 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -131.98 107.99 9.05 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 123.841 0.856 . . . . 0.0 109.035 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -55.96 -34.58 65.83 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.721 1.208 . . . . 0.0 110.454 -176.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -61.79 -44.84 96.08 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.242 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.35 -44.05 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 124.372 1.069 . . . . 0.0 109.351 177.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 7.0 mp -50.52 -45.24 56.56 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 119.123 0.874 . . . . 0.0 111.506 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -68.73 -37.09 79.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.829 0.74 . . . . 0.0 110.698 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -64.69 -40.49 95.48 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 118.969 0.804 . . . . 0.0 108.913 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.3 mt -69.12 -53.38 20.5 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.0 mt -61.44 -11.85 12.23 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.232 1.013 . . . . 0.0 113.575 -174.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 70.8 p -121.87 5.83 9.91 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.593 1.157 . . . . 0.0 111.661 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.63 119.58 7.86 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 124.58 1.152 . . . . 0.0 110.539 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -76.59 -15.6 59.8 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.186 0.994 . . . . 0.0 112.345 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.4 p -153.41 163.44 39.92 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 119.077 0.853 . . . . 0.0 111.502 -172.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 51.6 mp0 -59.09 -35.86 74.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.011 0.924 . . . . 0.0 109.18 169.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -59.15 -47.08 86.62 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 122.855 0.462 . . . . 0.0 110.96 175.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.57 -34.14 77.56 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.4 mt -66.34 -46.38 77.0 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.398 0.999 . . . . 0.0 109.276 174.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.11 -31.99 73.26 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.423 0.689 . . . . 0.0 112.445 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -58.59 -36.51 74.09 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.914 -1.116 . . . . 0.0 110.987 175.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 68.2 mt -71.74 -36.47 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 C-N-CA 124.083 0.953 . . . . 0.0 109.932 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 50.7 mm -52.88 -52.5 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 24.8 m -69.23 -29.15 67.03 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.215 -171.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.0 ttm105 -70.07 -37.11 75.39 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 125.375 1.47 . . . . 0.0 110.628 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.166 -1.352 . . . . 0.0 111.229 177.971 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpp? . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -68.06 112.38 5.0 Favored 'General case' 0 C--N 1.341 0.225 0 N-CA-C 104.281 -2.488 . . . . 0.0 104.281 168.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -53.41 -39.01 63.98 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.321 0.648 . . . . 0.0 110.368 -175.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.7 p -53.4 -19.74 3.82 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.972 1.709 . . . . 0.0 114.066 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -60.86 -23.45 65.15 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.924 1.238 . . . . 0.0 112.706 175.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.61 -14.71 15.53 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -170.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -102.27 109.58 60.63 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 120.465 1.484 . . . . 0.0 108.079 -173.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -62.05 -70.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.042 2.495 . . . . 0.0 113.664 -173.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.434 ' C ' ' H ' ' A' ' 11' ' ' SER . 34.5 tt0 -163.15 -71.9 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.936 0.894 . . . . 0.0 111.637 -174.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 m -69.86 6.4 1.21 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.69 1.196 . . . . 0.0 111.912 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.434 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER -71.31 -6.12 37.55 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.856 1.662 . . . . 0.0 113.593 -169.522 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.8 mt -122.75 130.14 74.69 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.787 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 -169.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.9 p -155.71 151.06 26.9 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.642 0.734 . . . . 0.0 111.914 -176.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.9 t -121.14 141.29 42.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 170.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.6 mt -136.58 145.99 29.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 C-N-CA 125.142 1.377 . . . . 0.0 108.214 -169.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -71.36 -38.43 71.58 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.807 -0.558 . . . . 0.0 111.699 175.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.9 p -174.33 148.15 1.23 Allowed 'General case' 0 C--O 1.237 0.403 0 N-CA-C 105.393 -2.077 . . . . 0.0 105.393 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.12 150.45 35.61 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 170.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.71 -41.55 81.98 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 176.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -157.61 169.65 24.19 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 126.78 2.032 . . . . 0.0 106.667 171.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -34.7 59.91 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.322 1.449 . . . . 0.0 112.718 169.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.43 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 26.2 mt-30 -60.64 -48.44 81.76 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.68 1.127 . . . . 0.0 109.383 170.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -63.5 -32.29 73.7 Favored 'General case' 0 C--O 1.223 -0.34 0 O-C-N 121.771 -0.581 . . . . 0.0 111.263 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.1 -36.29 83.09 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 121.833 -0.542 . . . . 0.0 110.059 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.99 -46.63 78.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 172.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -54.87 -45.85 74.67 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 121.751 -0.593 . . . . 0.0 110.697 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -65.32 -31.83 73.16 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 118.299 -0.858 . . . . 0.0 112.034 174.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.2 m -65.21 -20.3 66.37 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.618 1.099 . . . . 0.0 112.348 172.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.6 mmt -125.91 -20.02 4.7 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 114.919 1.452 . . . . 0.0 114.919 -168.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -60.03 -37.07 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 CA-C-N 120.714 1.597 . . . . 0.0 111.727 -169.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.3 m -65.39 -19.28 65.88 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.694 -0.629 . . . . 0.0 112.283 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 90.5 mt -91.36 -41.57 10.83 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.761 1.225 . . . . 0.0 109.144 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.6 tp -54.93 -42.68 72.55 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.007 0.923 . . . . 0.0 110.491 176.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -66.27 -28.33 68.63 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 125.312 1.445 . . . . 0.0 113.108 -173.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -99.54 18.52 17.71 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 118.241 0.473 . . . . 0.0 110.611 174.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.304 6.3 p30 46.72 38.43 5.81 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.539 1.536 . . . . 0.0 114.395 -171.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -68.42 -22.59 64.6 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.822 -1.174 . . . . 0.0 109.557 168.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.6 pt -143.43 177.24 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 126.446 1.898 . . . . 0.0 109.047 -176.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.8 m -117.16 157.46 25.91 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.603 1.961 . . . . 0.0 108.062 175.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.35 -31.79 70.65 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.026 -1.047 . . . . 0.0 112.94 -172.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -58.21 -33.24 69.08 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.887 -0.508 . . . . 0.0 111.878 175.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -60.09 -44.47 94.78 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.459 0.704 . . . . 0.0 110.494 -176.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -58.2 -50.94 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 174.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.0 tp60 -68.89 -26.17 64.98 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.412 -0.804 . . . . 0.0 112.058 -174.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.55 -43.64 89.39 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.493 1.042 . . . . 0.0 110.508 173.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 43.1 mt -68.3 -49.22 68.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.43 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.4 mttt -57.86 -42.51 84.63 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -61.35 -51.36 69.14 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.69 0.796 . . . . 0.0 111.242 -173.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 41.4 m -64.98 -39.9 94.16 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 118.306 0.503 . . . . 0.0 110.552 176.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 88.3 m . . . . . 0 CA--C 1.537 0.456 0 C-N-CA 122.964 0.506 . . . . 0.0 111.388 176.411 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 . . . . . 0 N--CA 1.456 -0.148 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 39.3 mm -136.22 136.01 49.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 104.919 -2.252 . . . . 0.0 104.919 -174.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -122.89 -30.65 3.78 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 123.215 0.606 . . . . 0.0 110.893 -170.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.57 157.94 27.08 Favored Pre-proline 0 N--CA 1.452 -0.343 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 173.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -51.99 120.02 6.56 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.026 1.818 . . . . 0.0 109.139 169.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 102.81 -15.68 55.31 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-O 117.942 -1.477 . . . . 0.0 114.117 -178.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 98.0 t -129.11 119.52 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 119.769 1.785 . . . . 0.0 109.538 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -116.49 166.85 11.61 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.689 1.596 . . . . 0.0 109.385 173.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 13.5 ttm -137.37 60.68 28.11 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.667 175.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -49.7 137.13 34.36 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 122.277 1.985 . . . . 0.0 113.98 -172.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -177.63 153.12 0.85 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 128.45 2.7 . . . . 0.0 106.706 -169.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.35 161.07 36.01 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 126.392 1.877 . . . . 0.0 107.459 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -53.63 143.14 39.68 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-O 117.651 -1.166 . . . . 0.0 108.876 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -46.83 -41.28 25.22 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.643 2.895 . . . . 0.0 113.246 -177.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -58.68 -14.72 9.17 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.601 1.56 . . . . 0.0 114.134 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 61.8 m -77.9 -4.61 47.62 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.66 0.784 . . . . 0.0 111.663 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 131.48 14.36 1.75 Allowed Glycine 0 C--N 1.337 0.597 0 CA-C-O 118.039 -1.423 . . . . 0.0 113.244 172.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.18 145.01 56.29 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 119.693 1.747 . . . . 0.0 109.289 169.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.5 mt -128.48 -34.82 2.0 Allowed 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.937 1.295 . . . . 0.0 110.291 -173.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -142.47 163.85 31.71 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 126.111 1.764 . . . . 0.0 108.026 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.1 m -97.49 130.79 44.54 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.187 0.595 . . . . 0.0 110.507 -176.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -173.74 179.48 45.09 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.742 1.163 . . . . 0.0 111.211 -176.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 56.4 mtt -144.89 167.85 21.64 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.168 1.387 . . . . 0.0 112.059 -172.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.3 m -138.33 166.16 24.91 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.076 1.75 . . . . 0.0 108.918 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 49.8 tp -147.85 85.47 1.55 Allowed 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.767 1.627 . . . . 0.0 108.025 -171.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.1 m -104.62 135.11 46.64 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.1 tp -129.58 142.62 50.71 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 173.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.6 mp -122.4 132.72 54.5 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.784 1.634 . . . . 0.0 106.795 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.0 -48.14 72.17 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 123.135 0.574 . . . . 0.0 110.237 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -90.43 -13.76 34.25 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.742 0.817 . . . . 0.0 112.317 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 64.31 -176.44 10.18 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 110.691 -0.963 . . . . 0.0 110.691 -168.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -148.53 167.8 3.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 169.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -120.3 96.6 5.21 Favored 'General case' 0 C--N 1.334 -0.079 0 O-C-N 121.643 -0.661 . . . . 0.0 110.699 -169.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.626 169.744 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 N--CA 1.459 -0.509 0 CA-C-O 121.808 0.67 . . . . 0.0 112.25 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 36.3 mm -111.04 136.34 47.4 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -177.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -108.74 -14.42 14.6 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 117.118 -1.42 . . . . 0.0 110.988 173.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.1 tp -139.3 136.25 34.67 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 120.854 1.661 . . . . 0.0 110.787 -175.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.6 mp -139.1 95.5 2.95 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 -172.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.7 mp -76.69 118.7 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 106.326 -1.731 . . . . 0.0 106.326 169.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -77.95 150.11 35.41 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 170.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -146.41 139.03 25.28 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 169.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 4.0 m -142.5 144.93 33.2 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 169.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.16 138.96 25.57 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -170.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -78.9 -23.28 44.88 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.818 0.447 . . . . 0.0 111.982 -175.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -143.68 155.51 44.25 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.838 0.855 . . . . 0.0 109.825 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.93 -35.66 73.47 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.648 0.779 . . . . 0.0 113.013 -177.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -76.14 -32.32 59.05 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.059 -1.026 . . . . 0.0 111.173 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.9 m -62.31 -41.57 98.63 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 169.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -57.88 -50.03 74.7 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.229 1.011 . . . . 0.0 110.056 172.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.0 mm -56.16 -54.34 28.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 118.709 0.686 . . . . 0.0 109.412 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.41 -39.4 96.18 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-N 118.775 0.716 . . . . 0.0 111.561 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.54 -49.62 62.45 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.183 0.993 . . . . 0.0 110.819 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.5 mm -55.63 -44.01 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.548 1.139 . . . . 0.0 108.974 176.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -70.72 -12.39 61.53 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.54 0.736 . . . . 0.0 112.032 -178.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.51 -45.21 13.83 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 170.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.84 -28.64 65.85 Favored 'General case' 0 CA--C 1.515 -0.371 0 O-C-N 121.919 -0.488 . . . . 0.0 111.732 -176.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.0 m -60.91 -20.76 62.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.241 0.616 . . . . 0.0 112.33 171.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -71.6 -22.57 61.7 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.672 1.124 . . . . 0.0 110.4 174.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 45.4 mt -103.3 -64.67 1.06 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.157 0.983 . . . . 0.0 110.284 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 19.2 mt -73.46 1.21 10.29 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -170.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.0 m -121.73 27.78 7.99 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.118 0.967 . . . . 0.0 110.954 174.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -139.4 95.96 3.02 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 -170.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.2 -25.53 33.51 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.131 0.972 . . . . 0.0 112.618 -172.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -63.51 -44.18 95.05 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 123.064 0.546 . . . . 0.0 110.076 175.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.3 -40.82 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 C-N-CA 125.087 1.355 . . . . 0.0 109.887 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 6.8 mp -51.41 -43.39 61.95 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 119.712 1.142 . . . . 0.0 111.678 -178.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -69.93 -36.81 75.61 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.75 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -63.76 -41.55 97.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 119.107 0.867 . . . . 0.0 108.831 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 6.8 mt -67.17 -52.93 35.34 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 60.9 mt -62.38 -14.68 42.69 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 63.5 p -116.87 5.48 12.99 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.391 1.076 . . . . 0.0 111.83 178.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.38 115.74 3.46 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.14 0.976 . . . . 0.0 109.37 177.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.5 m -87.96 -4.79 58.78 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.206 1.002 . . . . 0.0 111.933 -177.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.6 p -152.84 163.08 40.42 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.547 0.739 . . . . 0.0 110.08 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 58.8 mp0 -58.32 -37.64 75.52 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 123.943 0.897 . . . . 0.0 109.819 169.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -58.05 -45.97 86.17 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-O 119.359 -0.353 . . . . 0.0 110.356 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -65.38 -26.55 68.05 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 118.608 -0.71 . . . . 0.0 112.905 177.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 49.5 mt -72.69 -48.29 40.19 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 120.305 1.412 . . . . 0.0 109.0 172.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.09 -26.84 69.02 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 177.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -58.73 -37.97 77.34 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.007 -1.058 . . . . 0.0 110.607 172.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 67.6 mt -74.29 -36.26 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 124.018 0.927 . . . . 0.0 109.512 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 33.3 mm -55.16 -48.93 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 169.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.2 m -67.91 -26.62 66.07 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.367 -171.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 23.7 ttm105 -79.27 -16.03 57.06 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 126.852 2.061 . . . . 0.0 111.728 177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.91 0 N-CA-C 108.688 -1.765 . . . . 0.0 108.688 174.569 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tpt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.564 0.221 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -65.47 116.9 7.23 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.15 -39.05 81.23 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.651 0.78 . . . . 0.0 110.023 175.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.9 p -59.55 -14.97 15.2 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 124.937 1.295 . . . . 0.0 112.025 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -84.0 -27.14 28.63 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 123.951 0.901 . . . . 0.0 113.404 174.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -96.95 -39.01 9.58 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 122.889 0.476 . . . . 0.0 111.393 -174.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.03 127.02 57.22 Favored Pre-proline 0 CA--C 1.551 0.997 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -173.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -69.44 -76.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 122.552 2.168 . . . . 0.0 113.131 -170.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.455 ' C ' ' H ' ' A' ' 11' ' ' SER . 32.1 tt0 -166.39 -62.08 0.03 OUTLIER 'General case' 0 C--O 1.231 0.107 0 C-N-CA 125.317 1.447 . . . . 0.0 109.886 -177.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.04 11.75 0.28 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.93 1.692 . . . . 0.0 112.149 175.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.455 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -68.87 -23.33 64.2 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 126.938 2.095 . . . . 0.0 111.429 -169.642 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.6 mm -98.99 139.34 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.298 0 C-N-CA 124.604 1.161 . . . . 0.0 108.016 -169.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 m -158.91 128.46 5.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 118.398 0.545 . . . . 0.0 109.857 169.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 p -96.74 142.94 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 105.613 -1.995 . . . . 0.0 105.613 168.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.41 HG22 ' H ' ' A' ' 17' ' ' SER . 21.4 mt -138.31 148.61 24.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 -169.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -65.72 -48.72 71.01 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.451 -0.781 . . . . 0.0 110.309 169.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -169.67 148.46 3.66 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 105.334 -2.099 . . . . 0.0 105.334 -178.315 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.34 153.47 42.33 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 171.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -54.49 -43.23 71.61 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.381 0.673 . . . . 0.0 110.093 173.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -163.58 177.07 9.08 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 126.938 2.095 . . . . 0.0 107.765 169.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -54.81 -36.39 64.91 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 126.285 1.834 . . . . 0.0 113.937 175.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.4 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.8 mt-30 -62.52 -49.79 73.94 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 120.328 1.422 . . . . 0.0 108.459 171.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -60.65 -31.46 70.68 Favored 'General case' 0 C--O 1.222 -0.362 0 O-C-N 122.067 -0.396 . . . . 0.0 111.833 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.57 83.17 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.473 -0.767 . . . . 0.0 110.221 -178.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.3 -45.06 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 169.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -57.4 -46.56 83.33 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 122.959 0.503 . . . . 0.0 110.163 -176.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -63.43 -36.15 82.78 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.976 1.31 . . . . 0.0 111.771 172.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.5 m -62.66 -21.38 65.67 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.636 1.107 . . . . 0.0 112.504 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.7 mmt -122.43 -18.82 6.6 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -169.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.7 p -60.88 -35.92 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 121.152 1.796 . . . . 0.0 111.74 -171.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -67.16 -21.58 65.8 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.968 0.804 . . . . 0.0 111.998 179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.8 mt -83.41 -43.97 15.31 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.166 0.986 . . . . 0.0 108.658 171.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 34.2 tp -57.19 -42.85 82.01 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.331 1.052 . . . . 0.0 111.038 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.91 -30.14 67.6 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 126.271 1.829 . . . . 0.0 113.256 -176.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -108.93 20.73 18.11 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.377 0.0 OUTLIER 42.4 38.48 1.22 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.379 2.272 . . . . 0.0 115.38 -172.533 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -66.19 -21.18 66.31 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.416 -0.802 . . . . 0.0 110.081 168.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.1 pt -149.05 175.91 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 127.074 2.15 . . . . 0.0 108.488 -173.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.5 p -113.58 166.33 11.63 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.458 1.503 . . . . 0.0 108.486 169.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.46 -28.16 69.78 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.023 -1.048 . . . . 0.0 111.327 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -61.49 -38.08 86.0 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 121.679 -0.638 . . . . 0.0 111.301 176.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -57.11 -48.0 79.7 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.607 0.763 . . . . 0.0 109.85 178.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.0 mt -59.04 -50.39 79.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 124.99 1.316 . . . . 0.0 109.04 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -68.05 -27.34 66.43 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.954 -174.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.96 -43.38 86.42 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.4 1.0 . . . . 0.0 110.651 172.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 18.3 mt -68.06 -49.39 68.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.4 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 86.3 mttt -60.24 -47.09 87.46 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -174.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.64 -44.17 94.63 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.607 0.763 . . . . 0.0 110.923 -175.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.6 m -63.01 -44.5 95.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.989 0.516 . . . . 0.0 110.02 175.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.9 m . . . . . 0 CA--C 1.537 0.453 0 C-N-CA 123.759 0.824 . . . . 0.0 111.516 176.496 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 . . . . . 0 N--CA 1.454 -0.241 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 50.1 mm -128.58 143.64 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 105.494 -2.039 . . . . 0.0 105.494 -177.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 mp -132.02 -31.51 1.48 Allowed 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -169.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -163.53 163.45 16.38 Favored Pre-proline 0 C--O 1.236 0.351 0 C-N-CA 124.881 1.272 . . . . 0.0 107.596 -175.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.25 112.01 0.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.25 2.633 . . . . 0.0 111.846 171.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.17 4.69 77.54 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-O 117.471 -1.738 . . . . 0.0 114.618 176.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.49 126.89 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 119.977 1.889 . . . . 0.0 109.572 -169.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.76 171.01 12.11 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 125.879 1.672 . . . . 0.0 109.875 177.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.1 ttm -146.72 66.17 10.53 Favored Pre-proline 0 CA--C 1.54 0.578 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -50.67 137.05 42.08 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 121.178 1.252 . . . . 0.0 112.972 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -177.56 155.75 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 129.776 3.23 . . . . 0.0 105.279 -170.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.11 163.44 30.81 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.557 1.143 . . . . 0.0 108.336 171.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -52.11 139.08 35.22 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-O 118.024 -0.988 . . . . 0.0 109.413 175.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -44.67 -47.91 10.98 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.961 3.107 . . . . 0.0 113.335 -177.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -69.11 -4.26 16.56 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -175.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 73.7 m -78.94 -4.32 49.27 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.233 -0.917 . . . . 0.0 111.976 172.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 136.62 13.64 0.96 Allowed Glycine 0 CA--C 1.526 0.747 0 CA-C-N 119.485 1.039 . . . . 0.0 114.135 174.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.73 147.74 52.23 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 119.566 1.683 . . . . 0.0 108.804 169.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.2 mt -131.23 -31.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.65 1.18 . . . . 0.0 110.197 -175.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -144.91 154.61 42.79 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.311 1.444 . . . . 0.0 108.522 175.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 37.5 m -86.64 129.68 34.78 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 123.394 0.678 . . . . 0.0 109.886 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.23 -175.75 38.72 Favored Glycine 0 CA--C 1.527 0.808 0 C-N-CA 123.816 0.722 . . . . 0.0 111.313 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 49.5 mtp -145.09 170.14 16.77 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.242 1.417 . . . . 0.0 110.844 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 33.0 m -157.27 173.34 17.09 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.165 1.786 . . . . 0.0 108.701 170.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.3 tp -148.21 116.45 6.51 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.071 1.348 . . . . 0.0 110.904 -168.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 87.8 m -118.37 143.68 46.47 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 125.081 1.352 . . . . 0.0 108.746 -177.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -134.85 143.44 47.01 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 171.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.4 mp -121.72 133.08 54.94 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.124 1.77 . . . . 0.0 106.313 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -67.14 -48.04 69.24 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.793 -0.567 . . . . 0.0 110.913 177.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -88.1 -15.95 34.83 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.555 0.742 . . . . 0.0 112.001 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.92 -178.21 21.27 Favored Glycine 0 CA--C 1.532 1.1 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -168.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -145.32 167.57 9.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 169.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -121.5 93.35 3.98 Favored 'General case' 0 C--N 1.333 -0.12 0 O-C-N 121.805 -0.56 . . . . 0.0 110.799 -169.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 . . . . . 0 CA--C 1.538 0.515 0 C-N-CA 123.743 0.817 . . . . 0.0 110.616 169.96 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo . . . . . 0 CA--C 1.534 0.52 0 CA-C-O 121.401 0.501 . . . . 0.0 111.7 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.7 mm -113.49 138.32 43.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 21.3 mtpp -112.05 -19.63 12.25 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 117.291 -1.338 . . . . 0.0 111.03 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.6 tp -133.66 131.71 39.85 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 120.218 1.372 . . . . 0.0 109.424 -170.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.6 mp -138.4 135.1 34.94 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -175.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.0 mt -113.12 127.84 70.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 169.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.22 145.89 25.91 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 107.634 -2.186 . . . . 0.0 107.634 169.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 6.9 tt -143.62 132.6 22.84 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 169.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 85.3 p -124.39 153.39 41.94 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 169.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -152.87 133.06 13.51 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 118.343 0.52 . . . . 0.0 110.189 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.24 -22.06 58.16 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.024 0.53 . . . . 0.0 111.938 177.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -148.65 156.32 42.24 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.311 1.044 . . . . 0.0 109.642 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.41 -34.49 72.53 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -177.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.64 -30.94 61.8 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 120.749 -1.219 . . . . 0.0 111.065 177.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.1 m -67.16 -37.1 83.19 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.632 -0.668 . . . . 0.0 110.342 171.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -59.04 -49.02 79.48 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 123.857 0.863 . . . . 0.0 109.585 170.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 14.7 mm -54.29 -49.62 62.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 176.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.16 -42.79 97.32 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-N 119.199 0.908 . . . . 0.0 112.478 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.42 -40.47 67.09 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.398 0.679 . . . . 0.0 111.199 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -58.03 -47.0 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 C-N-CA 125.391 1.477 . . . . 0.0 107.501 173.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -67.74 0.15 3.55 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.347 1.459 . . . . 0.0 112.661 178.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -100.3 -54.76 2.78 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 124.824 1.25 . . . . 0.0 107.868 169.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.4 pp -64.43 -21.68 66.72 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -178.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 54.5 p -59.39 -30.39 68.41 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 123.62 0.768 . . . . 0.0 111.844 175.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -70.14 -11.15 60.68 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.545 -0.722 . . . . 0.0 110.975 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 35.2 mt -110.64 -63.62 1.37 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.115 0.966 . . . . 0.0 111.008 176.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 17.1 mt -70.6 -17.3 62.9 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -172.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.1 m -111.85 27.78 9.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.597 0.759 . . . . 0.0 110.402 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -132.8 97.7 4.11 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 107.227 -1.397 . . . . 0.0 107.227 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -57.85 -28.33 64.02 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.232 -175.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -67.27 -42.55 83.68 Favored 'General case' 0 C--O 1.23 0.072 0 CA-C-O 121.303 0.573 . . . . 0.0 109.772 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.2 mp -69.05 -42.94 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 40.2 mt -54.09 -44.98 71.66 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 118.893 -0.575 . . . . 0.0 111.061 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -69.7 -34.99 74.69 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 118.244 0.475 . . . . 0.0 110.109 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -72.28 -35.22 68.66 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.946 0.794 . . . . 0.0 109.883 -177.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 28.9 mt -67.28 -52.15 44.16 Favored 'General case' 0 C--O 1.225 -0.203 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 170.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.4 -24.66 56.79 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 66.9 p -105.46 5.33 31.49 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.737 1.215 . . . . 0.0 112.122 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -56.5 116.45 3.11 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 119.181 0.9 . . . . 0.0 110.413 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.3 m -68.63 -29.39 67.88 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 125.354 1.462 . . . . 0.0 111.342 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 33.1 m -147.68 164.33 33.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.971 1.309 . . . . 0.0 109.855 -169.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -54.6 -39.08 67.49 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.14 1.376 . . . . 0.0 110.389 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -56.08 -39.89 72.8 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.939 0.896 . . . . 0.0 112.389 -176.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -61.45 -43.99 97.89 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 118.824 0.738 . . . . 0.0 110.851 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.6 mt -62.87 -49.54 74.43 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -178.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.05 -27.89 67.33 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 174.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -81.24 -39.43 25.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 119.05 0.841 . . . . 0.0 110.6 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 63.4 mt -66.95 -33.0 60.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 123.958 0.903 . . . . 0.0 109.253 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 1.1 mm -48.37 -47.77 14.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.75 1.22 . . . . 0.0 111.287 169.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 16.3 m -66.18 -18.61 65.45 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.789 0.836 . . . . 0.0 112.562 -169.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 32.1 ttp85 -53.82 -35.67 61.68 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.696 1.198 . . . . 0.0 112.93 173.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.953 0 N-CA-C 107.876 -2.09 . . . . 0.0 107.876 -173.942 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.872 0.367 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -68.12 114.18 6.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.164 -175.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.0 -34.35 74.67 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.754 175.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.1 m -55.16 -15.92 2.68 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.0 0.818 . . . . 0.0 113.079 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -62.38 -23.32 66.74 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 172.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -106.5 -19.1 13.78 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -169.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -105.58 100.46 26.79 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 120.657 1.571 . . . . 0.0 107.589 -169.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -59.51 -67.41 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.462 2.775 . . . . 0.0 114.135 -170.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.426 ' C ' ' H ' ' A' ' 11' ' ' SER . 34.8 tt0 -162.26 -72.98 0.05 Allowed 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 123.78 0.832 . . . . 0.0 111.485 -174.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.7 m -67.75 2.6 1.83 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.559 1.144 . . . . 0.0 112.009 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.426 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER -68.52 -14.84 63.28 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.825 1.65 . . . . 0.0 112.745 -169.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.4 mt -117.8 130.35 72.81 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 105.123 -2.177 . . . . 0.0 105.123 -169.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 75.8 m -156.9 149.38 23.31 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.51 0.671 . . . . 0.0 111.231 -177.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.4 t -117.96 141.38 37.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 105.632 -1.988 . . . . 0.0 105.632 169.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.2 mt -135.37 145.01 32.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 125.602 1.561 . . . . 0.0 107.767 -169.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -68.19 -36.3 79.37 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.878 -0.514 . . . . 0.0 111.909 176.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 p -179.54 146.61 0.28 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.802 2.041 . . . . 0.0 106.346 -177.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.79 154.12 36.47 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 169.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.53 -42.94 83.89 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.215 0.606 . . . . 0.0 109.778 174.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -166.07 177.88 6.72 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 128.34 2.656 . . . . 0.0 107.29 172.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.46 -37.49 65.27 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 126.352 1.861 . . . . 0.0 114.015 175.354 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.435 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.1 mt-30 -62.03 -50.4 72.17 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.316 1.416 . . . . 0.0 108.364 172.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -60.04 -31.33 69.86 Favored 'General case' 0 C--O 1.222 -0.348 0 O-C-N 122.039 -0.413 . . . . 0.0 111.808 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.24 -38.01 84.48 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.582 -0.699 . . . . 0.0 110.234 -179.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.9 -45.35 91.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 169.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -56.69 -44.87 81.92 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 122.696 0.398 . . . . 0.0 110.208 -176.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -69.42 -28.29 66.01 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.758 1.223 . . . . 0.0 112.466 174.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m -64.71 -20.94 66.61 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.953 1.251 . . . . 0.0 111.53 170.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.4 mmt -122.69 -21.47 5.63 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -169.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -59.26 -35.27 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 120.944 1.702 . . . . 0.0 112.16 -169.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.5 m -64.43 -30.97 72.0 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.039 0.836 . . . . 0.0 111.417 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.7 mt -77.41 -43.22 33.33 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.807 0.843 . . . . 0.0 108.821 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 28.3 tp -56.67 -41.42 77.22 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.825 0.85 . . . . 0.0 110.956 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.61 -29.1 68.35 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 124.992 1.317 . . . . 0.0 112.78 -171.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -99.71 16.45 23.49 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.09 0.405 . . . . 0.0 110.654 172.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.336 3.4 p30 44.9 46.54 9.02 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.969 1.708 . . . . 0.0 114.167 -171.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -72.73 -19.96 61.29 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.596 -0.69 . . . . 0.0 109.14 167.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 pt -142.36 172.99 7.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 127.242 2.217 . . . . 0.0 108.531 -178.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m -108.23 159.03 16.94 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.165 1.786 . . . . 0.0 108.195 170.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -60.75 -33.72 73.36 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.86 -1.15 . . . . 0.0 111.74 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -62.34 -25.63 68.0 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.273 -0.892 . . . . 0.0 113.091 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -63.3 -45.73 90.01 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 119.521 1.055 . . . . 0.0 109.591 174.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.7 mt -59.9 -51.26 74.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 124.75 1.22 . . . . 0.0 108.816 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -68.75 -24.54 64.46 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.718 -174.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.5 -42.52 82.92 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.661 1.119 . . . . 0.0 110.765 172.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 14.9 mt -69.86 -49.22 58.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.435 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.8 mttt -59.81 -42.16 92.83 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -174.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -60.42 -48.07 83.37 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.734 0.814 . . . . 0.0 111.532 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.6 m -62.55 -43.32 99.1 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.309 0.504 . . . . 0.0 110.456 176.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 42.1 m . . . . . 0 CA--C 1.541 0.613 0 C-N-CA 123.527 0.731 . . . . 0.0 111.29 178.397 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 C--O 1.225 -0.208 0 N-CA-C 109.311 -0.625 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.5 mm -118.02 138.71 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -124.18 -33.36 3.09 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.255 0.622 . . . . 0.0 112.183 -169.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.51 164.19 20.0 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 124.844 1.258 . . . . 0.0 107.794 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -46.32 112.72 0.5 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.412 2.741 . . . . 0.0 111.997 172.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.41 5.38 85.04 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-O 117.792 -1.56 . . . . 0.0 114.677 176.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.9 t -127.26 122.92 60.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 120.066 1.933 . . . . 0.0 108.896 -169.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.71 171.1 10.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.802 1.641 . . . . 0.0 109.998 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.1 ttm -141.31 58.76 9.31 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 123.997 0.919 . . . . 0.0 111.516 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -56.32 128.12 28.83 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 121.807 1.671 . . . . 0.0 110.535 -176.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -179.11 162.69 1.24 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 127.809 2.444 . . . . 0.0 106.719 -169.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.83 171.79 13.91 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.791 1.237 . . . . 0.0 109.237 -175.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 -57.71 154.09 27.94 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-O 118.375 -0.822 . . . . 0.0 109.632 171.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.38 -40.17 83.74 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.499 2.132 . . . . 0.0 109.488 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.67 -16.97 30.29 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.948 2.099 . . . . 0.0 113.179 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 84.2 m -77.1 -9.41 58.72 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.736 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 135.78 17.26 0.84 Allowed Glycine 0 C--N 1.34 0.775 0 CA-C-O 118.234 -1.315 . . . . 0.0 113.859 175.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 148.42 51.78 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.435 1.617 . . . . 0.0 109.358 172.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.8 mt -129.24 -33.98 1.89 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 124.459 1.103 . . . . 0.0 110.685 -175.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -146.7 159.78 43.04 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.267 1.427 . . . . 0.0 108.524 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 85.2 m -92.47 125.47 37.13 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 123.379 0.672 . . . . 0.0 111.986 -175.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.62 -178.5 42.77 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 125.104 1.335 . . . . 0.0 111.294 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 13.1 mtm -147.36 169.79 18.71 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.962 1.705 . . . . 0.0 111.778 -176.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -136.88 161.02 37.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.503 1.921 . . . . 0.0 108.829 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 33.4 tp -143.03 106.28 4.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.818 2.047 . . . . 0.0 108.122 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.1 m -121.41 136.21 54.98 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -170.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tt -132.99 136.57 46.13 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 119.348 0.977 . . . . 0.0 108.404 175.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.0 mp -113.95 126.74 55.49 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 125.54 1.536 . . . . 0.0 107.311 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -61.78 -40.77 96.33 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.323 0.649 . . . . 0.0 110.892 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -96.35 -10.75 27.03 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.829 0.851 . . . . 0.0 112.175 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 61.3 -173.74 6.53 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -169.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -150.27 168.27 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 168.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -125.94 92.42 3.59 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 121.5 0.666 . . . . 0.0 110.203 -170.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 . . . . . 0 CA--C 1.537 0.45 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.337 171.516 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo . . . . . 0 N--CA 1.459 -0.504 0 CA-C-O 121.241 0.434 . . . . 0.0 111.453 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.0 mm -113.55 137.4 46.79 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -114.01 -15.13 12.35 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 116.519 -1.705 . . . . 0.0 111.146 175.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -138.73 144.06 39.33 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 121.249 1.841 . . . . 0.0 111.982 175.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -139.37 109.79 6.57 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.654 1.582 . . . . 0.0 107.386 -173.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.9 135.6 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 168.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -97.88 154.81 20.32 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 109.218 -1.553 . . . . 0.0 109.218 170.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -152.11 144.54 24.1 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 173.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 82.5 p -142.53 145.05 33.23 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 168.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.463 ' HA ' ' HA ' ' A' ' 77' ' ' THR . . . -144.1 146.91 33.11 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 119.27 0.941 . . . . 0.0 109.642 169.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.01 -14.56 59.12 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.483 -176.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -136.97 151.0 48.51 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.436 0.694 . . . . 0.0 110.202 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.43 -35.38 77.4 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -72.6 -30.39 64.32 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 121.139 -0.976 . . . . 0.0 110.917 176.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.6 m -66.46 -36.45 82.81 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.383 169.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -61.55 -45.79 92.66 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 119.303 0.956 . . . . 0.0 109.969 170.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 20.8 mm -55.7 -51.76 55.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 118.985 0.811 . . . . 0.0 109.274 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.26 -41.8 96.97 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-N 118.854 0.752 . . . . 0.0 111.669 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.37 -43.68 73.08 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.492 0.717 . . . . 0.0 111.22 -179.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.8 mm -59.11 -46.47 91.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 C-N-CA 124.847 1.259 . . . . 0.0 108.282 175.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -68.03 -12.05 60.1 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.352 -0.843 . . . . 0.0 111.562 -178.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -91.52 -50.16 5.93 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 124.216 1.006 . . . . 0.0 109.089 173.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.01 -26.81 65.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 121.69 -0.631 . . . . 0.0 111.478 -176.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.8 m -62.16 -22.18 65.66 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 119.118 -0.467 . . . . 0.0 112.168 173.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -65.97 -16.7 64.12 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.396 0.998 . . . . 0.0 110.336 172.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 34.1 mt -106.3 -60.91 1.59 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.612 1.565 . . . . 0.0 110.115 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 13.6 mt -69.15 -17.51 63.83 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -173.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 44.3 m -113.03 27.38 9.67 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 119.046 0.839 . . . . 0.0 110.595 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -139.31 96.87 3.17 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 -170.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.44 -25.77 38.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.296 1.038 . . . . 0.0 112.737 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.34 -45.8 89.54 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.373 0.606 . . . . 0.0 109.896 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -72.15 -38.21 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.3 mt -59.06 -33.37 70.71 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 119.312 0.96 . . . . 0.0 111.468 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -68.27 -43.34 78.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 120.858 -1.151 . . . . 0.0 110.334 172.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -64.73 -33.36 75.78 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.599 0.636 . . . . 0.0 110.665 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 2.6 pp -78.11 -45.41 23.44 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.119 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 53.8 mt -62.97 -24.03 67.7 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 120.225 1.375 . . . . 0.0 112.395 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 52.4 p -94.36 1.0 55.89 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.984 0.914 . . . . 0.0 111.646 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.96 107.67 2.76 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.131 0.878 . . . . 0.0 110.944 -176.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.2 p -77.42 -24.24 50.47 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.776 1.23 . . . . 0.0 112.208 176.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 29.8 m -147.55 157.47 43.57 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.86 0.864 . . . . 0.0 111.32 -169.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -50.04 -42.25 49.22 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.963 2.105 . . . . 0.0 111.643 177.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -70.57 -21.97 62.63 Favored 'General case' 0 CA--C 1.527 0.081 0 O-C-N 121.452 -0.78 . . . . 0.0 112.559 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -76.42 -32.2 58.36 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 120.163 1.347 . . . . 0.0 109.468 173.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.48 -43.42 76.99 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.269 -0.894 . . . . 0.0 108.642 174.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -56.44 -38.93 72.29 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 170.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.18 -39.01 91.29 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 119.154 0.888 . . . . 0.0 111.191 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 86.4 mt -62.03 -43.48 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.453 0.701 . . . . 0.0 109.578 175.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 18.0 mm -58.92 -43.56 88.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 C-N-CA 122.792 0.437 . . . . 0.0 110.299 176.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 52.3 m -72.67 -26.75 61.74 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 122.017 -0.427 . . . . 0.0 111.831 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 -70.06 -40.43 75.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.305 1.042 . . . . 0.0 110.049 174.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 C-N-CA 124.639 1.114 . . . . 0.0 110.477 -174.623 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 N--CA 1.485 1.312 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -62.31 113.08 2.7 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 168.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -53.49 -43.34 68.16 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.146 0.978 . . . . 0.0 108.794 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -54.05 -21.62 8.81 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.158 1.383 . . . . 0.0 113.69 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.99 -26.12 68.03 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.73 1.15 . . . . 0.0 112.659 173.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -97.85 -22.33 16.42 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 118.132 -0.937 . . . . 0.0 113.377 -171.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -104.04 101.16 24.11 Favored Pre-proline 0 N--CA 1.473 0.702 0 N-CA-C 105.342 -2.096 . . . . 0.0 105.342 -173.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.01 -77.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.075 2.517 . . . . 0.0 113.344 -169.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -159.54 160.09 34.12 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 127.146 2.178 . . . . 0.0 105.696 174.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 m 60.47 1.4 0.39 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.587 1.555 . . . . 0.0 112.99 -177.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.26 -7.63 55.32 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 127.543 2.337 . . . . 0.0 112.766 -169.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.5 mt -120.42 129.41 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.935 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -169.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.7 p -147.67 146.88 29.47 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.495 0.664 . . . . 0.0 112.093 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 93.7 t -127.47 136.52 60.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 171.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.0 mt -139.56 150.73 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 125.981 1.713 . . . . 0.0 106.906 -169.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 55.3 t60 -75.3 -48.78 21.6 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.838 -0.539 . . . . 0.0 109.718 172.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.1 p -157.27 150.15 23.45 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 178.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.68 156.04 26.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 170.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -59.59 -31.21 69.26 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.161 175.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -166.37 173.7 9.75 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 126.844 2.057 . . . . 0.0 107.704 177.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 1.2 p90 -64.12 -33.44 75.77 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 123.747 0.819 . . . . 0.0 111.501 169.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.412 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.5 mt-30 -59.23 -48.83 80.16 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 169.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.34 -30.89 71.78 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 122.048 -0.408 . . . . 0.0 111.438 -179.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.96 -36.8 83.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.529 -0.732 . . . . 0.0 110.026 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.32 -45.64 92.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 169.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -56.65 -45.92 81.35 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.766 0.427 . . . . 0.0 110.296 -177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -67.14 -31.04 71.21 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.872 1.269 . . . . 0.0 112.172 174.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.1 m -64.61 -21.81 66.81 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.875 1.216 . . . . 0.0 111.979 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.6 mmt -123.36 -20.48 5.61 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -169.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -60.99 -34.18 58.78 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-N 121.03 1.741 . . . . 0.0 111.595 -171.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.0 m -62.35 -26.44 68.45 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.778 0.717 . . . . 0.0 111.755 178.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.0 mt -84.83 -40.97 16.52 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.105 0.962 . . . . 0.0 109.179 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.3 tp -56.4 -40.92 75.44 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.775 0.83 . . . . 0.0 110.828 178.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -66.62 -25.44 66.6 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 125.827 1.651 . . . . 0.0 113.788 -171.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -110.82 23.62 13.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.768 0.427 . . . . 0.0 110.019 172.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.305 3.7 p30 45.39 43.06 8.2 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.483 1.513 . . . . 0.0 114.191 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.409 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 41.5 m-85 -71.18 -18.4 62.49 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.329 -0.857 . . . . 0.0 109.076 168.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 pt -145.8 170.77 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.323 2.249 . . . . 0.0 108.734 -178.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.4 m -107.44 161.19 15.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.052 1.741 . . . . 0.0 108.071 169.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -61.32 -30.94 70.81 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.066 -1.021 . . . . 0.0 112.349 -174.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -57.15 -36.2 70.45 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.686 -0.634 . . . . 0.0 111.823 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -58.07 -45.16 87.56 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 123.834 0.854 . . . . 0.0 110.319 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.7 mt -61.83 -50.7 79.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 124.771 1.228 . . . . 0.0 108.486 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -68.29 -26.57 65.71 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 118.089 -0.958 . . . . 0.0 111.924 -174.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.77 -44.91 86.52 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.491 1.041 . . . . 0.0 110.477 173.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.6 mt -69.28 -48.55 67.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 86.7 mttt -58.75 -47.68 83.81 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -175.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.79 -44.04 94.55 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 123.996 0.918 . . . . 0.0 111.012 -176.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -61.22 -44.06 97.88 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 122.743 0.417 . . . . 0.0 110.129 176.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.1 m . . . . . 0 CA--C 1.534 0.336 0 C-N-CA 124.07 0.948 . . . . 0.0 111.164 178.855 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 . . . . . 0 N--CA 1.454 -0.274 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.6 mm -124.14 141.5 44.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 mp -130.38 -28.39 2.1 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -169.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.13 161.03 26.54 Favored Pre-proline 0 C--O 1.237 0.396 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -56.72 114.52 1.95 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.017 1.811 . . . . 0.0 109.238 172.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.14 -4.87 57.41 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-O 117.792 -1.56 . . . . 0.0 114.2 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.1 t -129.22 128.53 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.93 1.865 . . . . 0.0 110.212 -169.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -131.67 167.39 19.54 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.292 1.837 . . . . 0.0 109.938 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 8.8 ttm -139.94 57.12 8.87 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.006 0.922 . . . . 0.0 112.151 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -45.81 138.08 11.97 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 121.863 1.709 . . . . 0.0 114.175 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 178.44 154.88 0.39 Allowed 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 129.121 2.968 . . . . 0.0 105.67 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -133.72 161.43 34.71 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 170.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -56.64 149.36 41.54 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-O 118.687 -0.673 . . . . 0.0 109.351 178.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -47.72 -41.01 31.54 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 123.131 2.554 . . . . 0.0 112.767 -177.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -62.74 -15.44 53.12 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.352 1.461 . . . . 0.0 113.285 -177.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 84.7 m -79.8 -2.01 41.4 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.86 0.864 . . . . 0.0 111.705 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.99 20.07 1.51 Allowed Glycine 0 CA--C 1.523 0.548 0 CA-C-O 118.493 -1.171 . . . . 0.0 112.941 174.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.39 148.91 48.97 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 119.415 1.607 . . . . 0.0 108.665 169.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.7 mt -129.53 -33.69 1.85 Allowed 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.259 1.024 . . . . 0.0 110.529 -176.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.409 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 73.7 mttt -145.67 153.85 41.46 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 125.281 1.432 . . . . 0.0 107.694 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.7 m -84.8 126.55 33.53 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 122.854 0.462 . . . . 0.0 109.985 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.95 179.67 42.13 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.665 1.126 . . . . 0.0 110.385 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 60.3 mtp -147.82 168.47 22.1 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.298 1.039 . . . . 0.0 112.767 -173.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -138.65 164.14 30.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.251 1.821 . . . . 0.0 109.441 174.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 31.3 tp -146.77 100.93 3.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.135 2.174 . . . . 0.0 108.837 177.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 92.2 m -117.27 135.19 54.0 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.316 1.046 . . . . 0.0 109.407 -172.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.4 tp -124.99 139.22 54.01 Favored 'General case' 0 CA--C 1.526 0.036 0 C-N-CA 123.795 0.838 . . . . 0.0 108.833 174.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mp -118.3 126.41 52.07 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 126.519 1.928 . . . . 0.0 105.828 175.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -72.23 -35.23 68.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 119.039 0.836 . . . . 0.0 112.31 -178.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 52.1 mm-40 -81.07 -20.08 42.33 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.633 0.773 . . . . 0.0 111.241 172.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 65.2 -174.5 16.5 Favored Glycine 0 CA--C 1.532 1.142 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 -168.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -146.7 165.38 7.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 105.779 -1.934 . . . . 0.0 105.779 168.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -126.75 94.3 4.01 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -169.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 124.478 1.111 . . . . 0.0 110.948 174.844 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo . . . . . 0 N--CA 1.46 -0.447 0 CA-C-O 121.597 0.582 . . . . 0.0 112.558 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 40.5 mm -116.82 132.4 66.64 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 106.97 -1.493 . . . . 0.0 106.97 178.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -98.63 -35.48 10.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 117.658 -1.163 . . . . 0.0 109.55 169.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -115.51 129.96 56.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 119.804 1.184 . . . . 0.0 110.512 -169.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mp -131.38 104.74 7.18 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -80.27 138.96 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 168.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -99.42 148.88 18.81 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 108.312 -1.915 . . . . 0.0 108.312 169.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.75 137.55 25.21 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.001 -1.851 . . . . 0.0 106.001 169.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 92.6 p -132.07 147.44 52.44 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 126.305 1.842 . . . . 0.0 106.188 168.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -148.0 133.6 18.79 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -178.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.15 -18.53 59.08 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.239 -0.41 . . . . 0.0 111.781 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -144.25 153.38 41.98 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.852 0.861 . . . . 0.0 110.079 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.17 -35.23 74.88 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.48 -31.12 62.1 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 120.933 -1.104 . . . . 0.0 111.086 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.9 m -64.63 -39.2 93.29 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.845 -0.534 . . . . 0.0 110.261 170.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -58.55 -49.97 75.48 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 123.508 0.723 . . . . 0.0 109.798 171.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 16.4 mm -55.29 -52.13 48.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.94 -41.0 99.19 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 118.971 0.805 . . . . 0.0 111.761 -176.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.27 -46.61 73.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.483 0.713 . . . . 0.0 110.725 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.2 mm -57.72 -46.71 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 124.853 1.261 . . . . 0.0 108.632 176.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -68.21 -14.91 63.34 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.299 -0.876 . . . . 0.0 111.512 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -90.15 -47.38 7.84 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 123.895 0.878 . . . . 0.0 109.539 174.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 4.3 pp -70.58 -25.83 63.25 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 121.75 -0.594 . . . . 0.0 111.51 -176.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.0 m -60.77 -21.99 63.61 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 172.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.72 -17.13 64.7 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.35 0.977 . . . . 0.0 110.268 173.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 44.9 mt -105.71 -61.85 1.44 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.26 1.424 . . . . 0.0 109.883 177.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 16.6 mt -68.97 -12.73 61.93 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.3 m -118.38 29.04 7.99 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.993 0.815 . . . . 0.0 110.4 177.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -131.86 99.71 4.84 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.577 1.151 . . . . 0.0 108.052 175.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -57.47 -25.6 59.96 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.038 -0.983 . . . . 0.0 112.488 -176.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -62.68 -48.98 76.91 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.139 0.576 . . . . 0.0 109.822 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.64 -41.26 85.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 123.9 0.88 . . . . 0.0 108.814 178.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 34.5 mt -53.91 -43.44 69.73 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 118.64 0.655 . . . . 0.0 111.605 -172.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -69.87 -32.31 70.6 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.449 0.568 . . . . 0.0 110.234 -178.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -71.18 -36.68 72.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -178.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 48.6 mt -62.24 -55.57 27.13 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 169.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 58.2 mt -62.42 -9.43 8.35 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -172.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 67.9 p -121.78 4.83 10.0 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.342 1.457 . . . . 0.0 111.546 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.53 113.01 2.21 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.054 0.942 . . . . 0.0 110.527 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.1 m -75.16 -22.49 58.07 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.632 0.773 . . . . 0.0 111.942 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.2 m -147.13 155.49 42.19 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.867 0.867 . . . . 0.0 109.895 -169.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -62.18 -31.93 72.49 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 123.775 0.83 . . . . 0.0 110.506 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -57.61 -36.5 71.85 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 123.06 0.544 . . . . 0.0 111.756 173.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -68.15 -38.07 81.74 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.75 0.82 . . . . 0.0 111.438 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 59.4 mt -68.46 -46.56 69.44 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -56.97 -35.2 68.87 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.277 1.031 . . . . 0.0 112.83 173.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -63.22 -45.18 92.82 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 119.36 0.982 . . . . 0.0 110.064 176.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 83.6 mt -62.73 -37.62 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 C-N-CA 123.955 0.902 . . . . 0.0 109.936 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 25.0 mm -60.39 -49.01 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 118.412 0.551 . . . . 0.0 110.409 170.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 44.2 m -66.16 -24.96 66.74 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -168.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -65.31 -33.52 76.17 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.85 0.75 . . . . 0.0 111.118 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.132 0 CA-C-O 117.52 -1.711 . . . . 0.0 109.197 -169.398 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.0 ttm . . . . . 0 N--CA 1.487 1.396 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -64.17 114.27 4.09 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -54.35 -43.73 71.55 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.141 1.376 . . . . 0.0 109.457 -178.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.8 -18.43 8.52 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.246 1.418 . . . . 0.0 113.183 -177.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -66.99 -31.12 71.46 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.449 1.022 . . . . 0.0 111.648 176.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -87.86 -30.65 20.0 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.508 -0.758 . . . . 0.0 112.346 -173.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -91.13 109.81 37.97 Favored Pre-proline 0 CA--C 1.543 0.706 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -176.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.3 -83.55 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.835 2.357 . . . . 0.0 112.625 -169.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -157.39 163.21 38.82 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 127.257 2.223 . . . . 0.0 106.113 172.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 57.58 5.06 0.28 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.771 1.628 . . . . 0.0 113.125 -175.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.4 p -81.98 1.28 36.21 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.734 2.814 . . . . 0.0 113.393 -168.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.4 mt -131.61 123.26 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -169.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.0 m -142.6 146.42 34.54 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 123.413 0.446 . . . . 0.0 111.488 -176.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -118.81 141.25 39.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 105.496 -2.039 . . . . 0.0 105.496 169.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.3 mt -140.69 148.23 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 C-N-CA 125.714 1.606 . . . . 0.0 107.441 -169.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -69.37 -52.62 25.36 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 172.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 t -162.03 163.56 28.72 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 169.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.93 158.45 21.57 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.92 -0.771 . . . . 0.0 108.92 173.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -59.07 -43.43 91.75 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.419 174.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -164.53 177.41 8.14 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 128.031 2.532 . . . . 0.0 107.555 173.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -55.52 -37.88 68.49 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.028 1.731 . . . . 0.0 113.819 176.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.401 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.9 mt-30 -62.64 -49.71 74.09 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 120.158 1.345 . . . . 0.0 108.489 173.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -60.41 -33.28 72.28 Favored 'General case' 0 C--O 1.223 -0.314 0 O-C-N 121.906 -0.496 . . . . 0.0 111.707 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.32 -37.3 86.67 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.645 -0.66 . . . . 0.0 110.637 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.97 -47.14 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 170.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -58.87 -48.97 79.51 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 123.266 0.626 . . . . 0.0 110.374 -174.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -60.81 -31.32 70.72 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.508 1.123 . . . . 0.0 111.4 173.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.9 m -82.66 -9.02 59.56 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 119.566 1.075 . . . . 0.0 113.676 179.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 14.2 mmt -121.26 -20.93 6.54 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.12 0.873 . . . . 0.0 112.821 -176.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.8 p -57.47 -34.03 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 120.352 1.433 . . . . 0.0 111.982 -173.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.0 m -65.07 -29.43 70.31 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.211 0.914 . . . . 0.0 111.902 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.2 mt -79.5 -42.47 25.15 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.092 0.957 . . . . 0.0 108.737 173.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.6 -44.01 85.11 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.921 0.888 . . . . 0.0 110.763 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.6 -28.76 67.46 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 126.651 1.98 . . . . 0.0 113.136 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -111.4 21.06 16.65 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.292 0.7 OUTLIER 47.99 33.44 3.44 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.132 1.773 . . . . 0.0 114.67 -178.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -67.86 -22.18 65.13 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.865 -1.147 . . . . 0.0 111.318 169.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.1 pt -145.37 172.59 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 C-N-CA 126.26 1.824 . . . . 0.0 108.235 -174.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 m -108.98 161.04 15.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.618 1.567 . . . . 0.0 108.366 172.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.57 -32.54 72.64 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.863 -1.148 . . . . 0.0 111.464 -178.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -59.01 -36.31 74.71 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.771 -0.581 . . . . 0.0 111.877 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -58.73 -48.24 81.84 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 123.386 0.674 . . . . 0.0 109.487 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 28.8 mt -57.97 -49.91 79.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 124.336 1.054 . . . . 0.0 108.923 178.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -68.19 -26.96 66.0 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.06 -0.971 . . . . 0.0 111.831 -175.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.24 -40.1 89.06 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.812 1.187 . . . . 0.0 110.815 172.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.7 mt -67.97 -51.91 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.0 mttt -58.9 -43.84 91.08 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -175.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -63.76 -45.76 88.35 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.465 1.106 . . . . 0.0 111.124 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 27.7 m -63.22 -38.2 90.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.402 0.546 . . . . 0.0 110.794 177.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 88.0 m . . . . . 0 N--CA 1.45 -0.44 0 C-N-CA 124.136 0.974 . . . . 0.0 109.578 177.404 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 C--O 1.235 0.303 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.7 mm -131.22 134.33 61.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 102.179 -3.267 . . . . 0.0 102.179 172.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -116.92 -28.92 6.15 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -168.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -165.73 163.67 12.42 Favored Pre-proline 0 C--O 1.237 0.437 0 C-N-CA 125.311 1.444 . . . . 0.0 107.536 -177.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -46.52 116.88 1.76 Allowed 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 123.027 2.485 . . . . 0.0 110.993 169.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.8 0.93 83.28 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.47 -1.739 . . . . 0.0 114.888 175.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.2 t -127.83 126.59 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 120.232 2.016 . . . . 0.0 109.605 -170.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.15 164.58 22.17 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 125.595 1.558 . . . . 0.0 110.06 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 tmm? -149.05 76.95 9.35 Favored Pre-proline 0 C--O 1.223 -0.313 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -59.04 -89.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 122.849 2.366 . . . . 0.0 114.985 -169.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . 0.254 0.0 OUTLIER 51.26 177.15 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.025 2.13 . . . . 0.0 113.943 -169.176 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.53 159.88 40.21 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 125.307 1.443 . . . . 0.0 108.568 177.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -62.53 147.78 91.75 Favored Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.09 177.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -44.58 -44.42 13.76 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 124.479 3.452 . . . . 0.0 114.032 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.42 -12.04 12.86 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.286 1.435 . . . . 0.0 113.843 -176.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 60.0 m -79.28 -4.15 49.38 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.615 0.643 . . . . 0.0 111.62 179.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 127.36 19.2 1.93 Allowed Glycine 0 C--N 1.337 0.622 0 CA-C-O 118.539 -1.145 . . . . 0.0 113.249 175.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.49 149.32 50.23 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 119.206 1.503 . . . . 0.0 109.075 169.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -130.78 -31.52 1.74 Allowed 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.375 1.07 . . . . 0.0 110.661 -174.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -146.18 157.35 43.82 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.011 1.324 . . . . 0.0 108.951 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.7 m -90.31 126.15 35.76 Favored 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 123.041 0.536 . . . . 0.0 110.203 -177.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -168.98 -174.52 37.62 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 125.482 1.515 . . . . 0.0 111.252 -175.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 40.8 mtt -151.42 170.06 20.5 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.103 1.761 . . . . 0.0 111.064 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 36.6 m -153.41 169.65 22.63 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.56 1.544 . . . . 0.0 109.931 171.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 18.1 tp -142.91 130.18 20.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 127.145 2.178 . . . . 0.0 109.561 -169.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 35.7 m -136.52 133.86 36.93 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 17.3 tp -125.38 134.51 52.14 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 171.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.5 mp -110.63 133.52 53.25 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 173.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -67.6 -43.87 79.46 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 118.308 0.504 . . . . 0.0 110.676 176.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -84.54 -24.73 29.17 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.806 0.842 . . . . 0.0 112.271 -177.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 71.69 165.54 7.27 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -168.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -135.2 163.47 35.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 169.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -120.55 93.36 4.02 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.867 0.841 . . . . 0.0 111.422 -168.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 . . . . . 0 CA--C 1.538 0.508 0 CA-C-N 114.66 -1.154 . . . . 0.0 112.221 171.015 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo . . . . . 0 N--CA 1.457 -0.647 0 CA-C-O 121.035 0.348 . . . . 0.0 112.93 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.6 mm -115.81 128.23 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 174.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -94.43 -34.01 12.9 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.458 -1.258 . . . . 0.0 109.858 169.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -119.51 131.15 55.5 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 120.333 1.424 . . . . 0.0 110.17 -169.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mp -129.37 135.4 48.67 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -111.32 132.16 60.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 168.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -103.38 157.46 17.66 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -146.95 154.59 41.44 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 -179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 88.3 p -142.85 146.15 33.85 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 104.63 -2.359 . . . . 0.0 104.63 168.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.23 129.43 12.77 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 119.535 1.061 . . . . 0.0 108.987 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -74.57 -18.92 60.5 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.819 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -141.86 151.97 43.2 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 123.715 0.806 . . . . 0.0 110.328 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.65 -33.66 73.13 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -175.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -78.21 -31.06 49.21 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 119.313 0.96 . . . . 0.0 111.061 177.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.0 m -62.81 -39.4 94.18 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 169.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.91 -48.34 80.17 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.387 1.075 . . . . 0.0 110.483 171.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.5 mm -58.71 -51.89 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.49 -38.8 95.43 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 118.912 0.778 . . . . 0.0 111.651 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.8 -53.5 39.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.306 1.042 . . . . 0.0 110.394 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.4 mm -51.17 -48.16 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.663 1.585 . . . . 0.0 108.56 176.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -68.27 -16.09 63.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.425 0.69 . . . . 0.0 112.006 -176.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -87.5 -44.83 11.0 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.631 0.773 . . . . 0.0 109.613 172.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.8 pp -68.78 -25.77 64.87 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 118.662 0.664 . . . . 0.0 111.316 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 49.1 m -60.79 -21.88 63.53 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 123.759 0.823 . . . . 0.0 112.32 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -66.5 -17.68 64.94 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.307 0.958 . . . . 0.0 110.299 173.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 36.1 mt -105.95 -58.69 1.88 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.382 1.473 . . . . 0.0 109.898 177.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.8 -28.13 65.7 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 114.433 1.272 . . . . 0.0 114.433 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 42.0 m -108.52 26.73 10.15 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.912 0.778 . . . . 0.0 110.844 -175.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -132.42 97.51 4.12 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 124.679 1.192 . . . . 0.0 108.054 178.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.54 -27.46 49.06 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.841 0.856 . . . . 0.0 112.526 -177.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.13 -44.83 87.42 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.104 0.562 . . . . 0.0 110.013 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.62 -44.98 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 174.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.8 mt -53.74 -45.73 70.62 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 118.429 0.559 . . . . 0.0 111.555 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -65.78 -38.55 89.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.435 0.561 . . . . 0.0 110.705 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -70.1 -32.45 70.51 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 118.64 0.654 . . . . 0.0 110.11 -177.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 25.6 mt -68.75 -52.97 24.82 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 55.1 mt -59.17 -13.12 6.37 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -176.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 81.4 p -123.84 10.87 8.97 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.223 1.409 . . . . 0.0 110.898 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.01 119.02 5.58 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 124.624 1.17 . . . . 0.0 109.879 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.5 p -71.95 -16.17 62.09 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.321 1.048 . . . . 0.0 112.307 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 73.4 p -159.38 164.87 34.31 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.571 0.623 . . . . 0.0 111.067 -172.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.27 -33.81 75.35 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 169.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -60.36 -37.47 80.8 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 121.827 -0.545 . . . . 0.0 111.573 174.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -77.28 -28.54 53.43 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 119.703 1.138 . . . . 0.0 110.713 179.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 35.2 mt -65.44 -48.63 72.09 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 120.286 1.403 . . . . 0.0 108.289 169.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.04 -34.1 69.71 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.821 1.248 . . . . 0.0 113.189 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -63.17 -42.01 99.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 119.066 0.848 . . . . 0.0 110.487 176.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 91.4 mt -68.47 -36.54 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 123.343 0.657 . . . . 0.0 109.527 179.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.3 mm -57.85 -52.64 55.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 169.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 28.8 m -64.11 -28.02 69.49 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 122.816 0.446 . . . . 0.0 111.484 -170.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -59.64 -28.5 67.28 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.675 1.59 . . . . 0.0 113.396 175.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.911 0 N-CA-C 108.904 -1.679 . . . . 0.0 108.904 -174.452 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 tpt . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -65.98 110.0 2.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 168.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.51 -45.99 66.46 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.683 0.793 . . . . 0.0 109.746 -175.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.47 -19.93 6.66 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.279 1.832 . . . . 0.0 113.143 -176.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.4 -31.47 72.15 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 119.349 0.977 . . . . 0.0 111.995 175.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -88.3 -22.38 23.92 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.686 -174.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -99.4 100.14 9.9 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 -173.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.18 -81.13 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 123.689 2.926 . . . . 0.0 113.298 -169.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -157.05 161.03 39.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.43 2.292 . . . . 0.0 105.485 172.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 m 59.06 -0.12 0.15 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.568 1.547 . . . . 0.0 113.075 -174.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.1 p -80.05 4.65 16.43 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 128.397 2.679 . . . . 0.0 112.708 -169.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 6.6 mt -133.32 132.04 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 N-CA-C 104.145 -2.539 . . . . 0.0 104.145 -173.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.0 m -156.15 147.4 22.44 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 118.685 0.675 . . . . 0.0 111.066 -179.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 85.3 t -116.67 143.45 26.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 169.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mt -138.7 147.51 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 C-N-CA 126.245 1.818 . . . . 0.0 106.31 -172.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -72.47 -47.51 48.18 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.594 -0.691 . . . . 0.0 109.713 172.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.2 p -160.67 141.91 12.0 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.073 -1.455 . . . . 0.0 107.073 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.82 155.1 35.71 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -56.34 -44.83 80.42 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.631 0.772 . . . . 0.0 109.716 177.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -163.58 -176.92 4.93 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.824 2.05 . . . . 0.0 108.242 170.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -64.3 -32.79 74.52 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.455 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 35.0 mt-30 -58.88 -50.52 73.69 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.805 1.639 . . . . 0.0 107.206 171.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -60.73 -35.22 75.8 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 121.795 -0.566 . . . . 0.0 111.806 177.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.97 -31.94 72.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 121.894 -0.504 . . . . 0.0 110.905 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.25 -48.53 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 170.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -55.96 -45.63 78.84 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 118.23 0.468 . . . . 0.0 110.442 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -64.69 -28.91 69.92 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 118.031 -0.985 . . . . 0.0 112.343 174.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.9 m -69.9 -19.95 63.39 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.223 1.374 . . . . 0.0 112.224 172.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.2 mmt -123.86 -18.68 5.93 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -168.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.2 p -57.03 -37.88 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 120.273 1.397 . . . . 0.0 112.591 -169.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.3 m -67.21 -27.7 67.46 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.825 0.738 . . . . 0.0 111.568 -178.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.4 mt -77.43 -44.37 29.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.649 0.78 . . . . 0.0 108.986 172.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -56.4 -51.02 69.91 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.109 0.964 . . . . 0.0 110.092 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -56.21 -28.59 58.85 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 126.576 1.95 . . . . 0.0 113.757 -176.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -113.71 24.45 12.12 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 123.057 0.543 . . . . 0.0 109.996 -175.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 61.66 20.69 11.54 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 171.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -71.24 -24.18 62.14 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.894 -1.129 . . . . 0.0 111.158 174.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.4 pt -143.88 176.3 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.101 1.76 . . . . 0.0 108.929 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m -114.26 160.56 18.9 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.597 1.959 . . . . 0.0 108.203 175.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -59.02 -37.47 76.98 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.907 1.231 . . . . 0.0 111.826 -175.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -60.71 -22.54 64.07 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.797 0.839 . . . . 0.0 113.206 175.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -65.25 -45.58 83.98 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.798 1.181 . . . . 0.0 109.934 174.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.99 -50.53 79.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -69.86 -23.86 63.34 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.952 -173.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.01 -42.7 90.74 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 120.149 1.341 . . . . 0.0 111.025 172.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.5 mt -70.09 -46.3 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.455 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.5 mttt -61.64 -40.62 95.55 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -65.13 -38.55 91.01 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 124.176 0.99 . . . . 0.0 111.445 178.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.9 m -61.72 -42.05 98.43 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.733 -0.604 . . . . 0.0 109.603 171.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 22.6 m . . . . . 0 CA--C 1.545 0.756 0 O-C-N 121.463 -0.773 . . . . 0.0 110.915 177.895 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.6 mm -124.91 136.02 62.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -121.97 -31.26 3.94 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 123.651 0.78 . . . . 0.0 110.923 -172.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.77 160.21 30.16 Favored Pre-proline 0 CA--C 1.534 0.351 0 C-N-CA 125.883 1.673 . . . . 0.0 106.708 173.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -49.84 119.91 5.36 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.394 2.063 . . . . 0.0 109.979 169.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.9 -6.2 73.07 Favored Glycine 0 CA--C 1.532 1.104 0 CA-C-O 117.843 -1.532 . . . . 0.0 114.465 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.6 t -126.25 117.35 48.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 119.769 1.785 . . . . 0.0 108.339 -170.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -118.76 168.8 10.4 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.412 1.085 . . . . 0.0 110.246 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 7.2 ttm -140.69 62.31 17.72 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 122.93 0.492 . . . . 0.0 111.99 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.59 135.64 48.54 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 121.56 1.506 . . . . 0.0 111.83 -179.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 176.42 157.61 0.27 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 128.28 2.632 . . . . 0.0 106.221 -170.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.13 163.92 30.46 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.207 1.403 . . . . 0.0 108.224 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -58.11 153.91 32.89 Favored Pre-proline 0 N--CA 1.465 0.312 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.104 175.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.3 -39.21 91.56 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 122.13 1.886 . . . . 0.0 110.446 -172.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -61.86 -15.31 41.27 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.704 1.602 . . . . 0.0 113.055 -178.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 83.7 m -79.11 -8.61 59.12 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.656 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 139.02 13.5 0.69 Allowed Glycine 0 C--N 1.339 0.736 0 CA-C-O 117.825 -1.542 . . . . 0.0 114.206 173.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.29 147.49 52.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.854 1.827 . . . . 0.0 109.625 173.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.1 mt -130.6 -35.55 1.48 Allowed 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.309 1.043 . . . . 0.0 110.32 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -148.6 158.34 44.06 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.292 1.437 . . . . 0.0 108.542 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.454 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 83.4 m -90.29 133.74 34.75 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 122.988 0.515 . . . . 0.0 111.927 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -177.34 -179.14 47.49 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.923 1.249 . . . . 0.0 111.11 -177.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 24.2 mtm -146.65 169.67 18.53 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 126.241 1.816 . . . . 0.0 110.775 -179.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.0 m -151.04 170.61 18.96 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.473 1.509 . . . . 0.0 109.425 171.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 tp -145.78 131.02 18.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 127.854 2.461 . . . . 0.0 108.408 -169.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 28.6 m -140.78 137.19 33.18 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -173.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -129.27 141.44 51.11 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 172.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.7 mp -119.61 126.83 52.12 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 126.398 1.879 . . . . 0.0 106.368 176.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.42 -44.73 90.32 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.423 0.556 . . . . 0.0 111.251 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 38.1 mm-40 -85.53 -23.54 27.65 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 124.292 1.037 . . . . 0.0 111.667 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 73.97 176.18 33.75 Favored Glycine 0 CA--C 1.532 1.145 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -168.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.93 160.27 13.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 169.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -109.76 101.61 10.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.67 0.748 . . . . 0.0 110.543 -168.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 . . . . . 0 CA--C 1.541 0.633 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.448 169.887 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo . . . . . 0 N--CA 1.46 -0.498 0 N-CA-C 113.407 0.503 . . . . 0.0 113.407 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 22.9 mm -84.93 136.32 23.01 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.291 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 172.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -111.59 -18.46 12.8 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 117.686 -1.149 . . . . 0.0 110.625 170.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 15.3 tp -140.4 135.56 32.21 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 120.001 1.273 . . . . 0.0 109.818 -173.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.3 mp -138.6 138.37 37.84 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 -174.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.1 mt -115.24 128.93 72.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 168.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.28 149.95 21.66 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 108.592 -1.803 . . . . 0.0 108.592 170.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -148.6 144.82 27.48 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 172.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.9 p -142.48 145.95 34.25 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 168.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.454 ' HA ' ' HA ' ' A' ' 77' ' ' THR . . . -145.96 145.85 30.81 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 118.553 0.615 . . . . 0.0 109.706 171.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.89 -16.94 59.96 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.477 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -137.61 155.8 48.78 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.362 0.665 . . . . 0.0 110.746 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.37 -38.62 90.27 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.342 0.657 . . . . 0.0 112.472 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -73.05 -31.1 64.2 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.211 -0.93 . . . . 0.0 110.837 178.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.3 m -64.36 -37.99 89.44 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.289 169.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -62.23 -44.64 96.1 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.779 171.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.6 -51.28 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-N 119.141 0.882 . . . . 0.0 108.874 177.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.59 -40.72 96.74 Favored Glycine 0 CA--C 1.531 1.063 0 CA-C-N 119.063 0.847 . . . . 0.0 111.916 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.15 70.7 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.617 0.767 . . . . 0.0 111.096 -179.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 5.0 mm -58.91 -46.12 91.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 125.201 1.4 . . . . 0.0 108.168 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.1 mm-40 -69.02 -9.97 55.18 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.135 -0.978 . . . . 0.0 111.623 -178.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.41 -50.63 5.54 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.929 0.892 . . . . 0.0 108.93 172.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.9 pp -68.52 -27.34 66.02 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.773 -0.579 . . . . 0.0 111.646 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.4 m -62.42 -20.98 65.04 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.318 0.508 . . . . 0.0 112.062 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -64.16 -19.12 65.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.283 0.947 . . . . 0.0 110.096 171.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 33.4 mt -108.12 -60.54 1.71 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.022 1.729 . . . . 0.0 110.941 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.4 mt -65.75 -18.13 65.11 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -175.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.6 m -111.39 26.84 10.25 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.268 0.94 . . . . 0.0 110.887 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -139.54 97.47 3.28 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -172.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -55.83 -27.39 51.24 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.789 0.836 . . . . 0.0 112.418 -175.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -61.95 -45.08 95.22 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 122.875 0.47 . . . . 0.0 110.125 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.5 mp -71.69 -45.04 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 123.662 0.785 . . . . 0.0 108.887 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.0 mt -55.69 -41.67 74.06 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.026 -172.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -70.83 -33.98 71.22 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 118.435 0.561 . . . . 0.0 110.327 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -66.13 -41.65 90.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.222 0.919 . . . . 0.0 108.764 179.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 21.4 mt -69.02 -48.08 63.86 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 64.1 mt -62.66 -5.9 3.1 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 178.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 73.8 p -122.6 11.73 9.89 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.346 1.458 . . . . 0.0 110.923 175.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.17 110.09 2.07 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 124.378 1.071 . . . . 0.0 109.974 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -73.99 -14.71 61.07 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.782 0.833 . . . . 0.0 112.303 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 82.1 p -151.73 163.74 38.48 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 118.943 0.792 . . . . 0.0 110.866 -174.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.74 -39.67 74.4 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.523 1.129 . . . . 0.0 109.671 169.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -59.93 -40.01 87.47 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 123.27 0.628 . . . . 0.0 110.84 177.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -65.85 -38.76 89.73 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 118.865 0.757 . . . . 0.0 112.261 177.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.3 mt -62.79 -48.24 79.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.637 1.108 . . . . 0.0 108.517 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.74 -37.19 73.17 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.561 1.145 . . . . 0.0 113.66 174.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.83 -39.72 95.21 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 121.187 -0.946 . . . . 0.0 110.099 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 49.9 mt -71.93 -35.76 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 123.718 0.807 . . . . 0.0 110.206 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 17.1 mm -57.01 -46.28 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 118.835 0.743 . . . . 0.0 109.776 169.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 43.8 m -65.02 -22.53 67.01 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -169.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . 0.412 ' HG2' HH11 ' A' ' 146' ' ' ARG . 6.1 mtt-85 -68.11 -35.72 78.59 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.978 0.808 . . . . 0.0 111.509 176.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.154 0 CA-C-O 117.779 -1.567 . . . . 0.0 110.834 -168.764 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.759 0.314 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -65.44 115.18 5.42 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -53.67 -45.33 70.25 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.466 1.104 . . . . 0.0 108.457 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.42 -27.1 5.83 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 126.519 1.928 . . . . 0.0 113.34 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.52 -28.38 68.36 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.947 0.794 . . . . 0.0 112.539 178.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -93.09 -14.68 26.97 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.03 0.932 . . . . 0.0 113.085 -173.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -102.65 114.43 65.33 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 120.561 1.528 . . . . 0.0 108.589 -173.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.82 -76.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.436 2.757 . . . . 0.0 113.46 -176.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.455 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.7 tp10 -162.52 -68.84 0.05 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.432 1.093 . . . . 0.0 110.957 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -67.32 4.53 0.95 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.923 1.289 . . . . 0.0 112.077 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.455 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -70.51 -8.73 53.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.534 1.934 . . . . 0.0 113.056 -170.742 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.9 mt -120.52 125.5 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -169.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.6 m -145.27 149.58 35.11 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.321 0.581 . . . . 0.0 111.219 -175.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.5 t -126.25 138.49 54.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 170.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.1 mt -139.25 150.45 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 -174.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -70.19 -46.69 64.07 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.699 -0.625 . . . . 0.0 110.282 177.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.1 p -164.15 146.66 9.15 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.89 160.98 28.77 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -57.48 -43.39 84.04 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.07 0.548 . . . . 0.0 110.417 173.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -168.35 178.86 4.69 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 127.038 2.135 . . . . 0.0 108.342 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -61.81 -34.33 75.74 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.807 1.643 . . . . 0.0 113.045 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.405 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 53.9 mm-40 -62.03 -50.93 70.03 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.663 1.574 . . . . 0.0 107.834 169.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -60.25 -35.44 75.5 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 121.836 -0.54 . . . . 0.0 111.705 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.1 -31.89 73.14 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.555 0.742 . . . . 0.0 110.751 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -71.16 -46.71 64.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 173.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -56.93 -45.86 82.45 Favored 'General case' 0 C--O 1.226 -0.18 0 O-C-N 121.656 -0.653 . . . . 0.0 110.517 178.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -64.1 -30.33 71.41 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.375 -0.821 . . . . 0.0 111.894 174.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 m -67.45 -27.29 66.91 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.587 1.085 . . . . 0.0 112.173 173.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 2.2 mmm -119.79 -13.54 9.09 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.087 1.312 . . . . 0.0 114.425 -169.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.6 p -58.21 -39.13 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 120.792 1.633 . . . . 0.0 112.723 -169.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.0 m -66.11 -22.78 66.41 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.017 0.826 . . . . 0.0 111.908 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.7 mt -82.55 -43.05 17.58 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.061 0.944 . . . . 0.0 108.925 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.82 -49.96 71.83 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.094 0.958 . . . . 0.0 109.737 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.58 -30.6 61.13 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 126.212 1.805 . . . . 0.0 113.947 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.8 mttm -111.27 22.66 14.94 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.35 -175.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 57.74 25.42 11.83 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.463 -0.79 . . . . 0.0 113.054 173.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -69.12 -25.72 64.54 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.279 -0.888 . . . . 0.0 110.368 169.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.3 pt -144.47 176.54 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 125.759 1.623 . . . . 0.0 109.288 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.5 m -116.61 159.1 22.66 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.7 2.0 . . . . 0.0 108.04 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -58.56 -33.44 69.92 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.651 1.114 . . . . 0.0 113.22 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -57.02 -32.23 65.94 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.169 0.587 . . . . 0.0 111.775 175.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -60.23 -45.77 92.09 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.366 0.666 . . . . 0.0 110.421 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.31 -49.32 83.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -69.6 -24.54 63.68 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.219 -177.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.47 -44.42 94.46 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 120.084 1.311 . . . . 0.0 110.488 174.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 56.1 mt -67.04 -47.04 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.5 mttt -58.67 -43.91 90.05 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 117.89 0.314 . . . . 0.0 110.781 -178.075 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -67.41 -39.87 85.54 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 124.272 1.029 . . . . 0.0 110.934 -178.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.6 m -62.14 -40.59 96.45 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.281 0.562 . . . . 0.0 110.223 173.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.4 m . . . . . 0 CA--C 1.54 0.562 0 C-N-CA 124.01 0.924 . . . . 0.0 110.917 177.817 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 23.8 mm -141.19 139.13 33.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 mp -132.09 -25.8 1.98 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -170.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.13 161.43 25.85 Favored Pre-proline 0 C--O 1.237 0.401 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 176.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -49.63 116.38 2.31 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.487 2.125 . . . . 0.0 111.005 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.55 4.92 69.84 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.152 -1.36 . . . . 0.0 114.501 177.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.6 t -129.5 122.69 55.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-N 119.33 1.565 . . . . 0.0 108.81 -169.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -121.09 166.03 14.49 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.297 1.439 . . . . 0.0 110.122 177.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 24.7 ttm -136.41 63.88 50.22 Favored Pre-proline 0 CA--C 1.542 0.663 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.73 173.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.52 147.57 22.68 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.18 1.92 . . . . 0.0 113.865 -173.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 174.07 154.92 0.12 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.535 2.334 . . . . 0.0 107.329 -169.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.66 151.7 50.47 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 106.657 -1.609 . . . . 0.0 106.657 169.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -53.6 141.86 43.62 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-O 117.429 -1.272 . . . . 0.0 109.265 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -43.67 -44.46 11.24 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 124.24 3.293 . . . . 0.0 114.645 -170.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -63.73 -9.23 13.18 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.689 1.196 . . . . 0.0 114.023 -177.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 61.7 m -76.63 -1.66 28.8 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.128 0.971 . . . . 0.0 111.867 175.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 129.09 13.48 2.4 Favored Glycine 0 C--N 1.336 0.577 0 CA-C-O 118.185 -1.341 . . . . 0.0 112.985 172.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.4 148.26 52.02 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 119.342 1.571 . . . . 0.0 109.278 170.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 86.2 mt -133.04 -31.05 1.3 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 124.751 1.22 . . . . 0.0 110.975 -173.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -143.91 166.84 23.81 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 126.057 1.743 . . . . 0.0 107.042 178.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.2 m -101.93 125.91 48.71 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 123.17 0.588 . . . . 0.0 109.734 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -174.28 175.76 46.67 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.714 1.149 . . . . 0.0 111.276 -177.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 56.8 mtt -140.72 167.71 21.53 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.803 1.241 . . . . 0.0 112.246 -170.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 p -144.25 165.33 28.18 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.136 1.774 . . . . 0.0 109.377 178.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.0 tp -146.92 110.81 5.01 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.191 1.797 . . . . 0.0 107.861 -169.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 31.5 m -127.02 139.35 53.08 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -171.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 12.1 tp -135.22 145.35 47.56 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 174.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -125.01 112.35 16.46 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 126.161 1.785 . . . . 0.0 106.193 -173.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -59.83 -24.79 64.47 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -116.79 -5.32 11.56 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.192 0.997 . . . . 0.0 112.088 -177.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.95 168.58 4.43 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.628 1.109 . . . . 0.0 113.49 -173.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 16.3 t -139.11 148.99 23.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 105.137 -2.172 . . . . 0.0 105.137 174.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -116.42 100.62 8.0 Favored 'General case' 0 C--N 1.334 -0.093 0 O-C-N 121.762 -0.586 . . . . 0.0 110.712 -168.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 CA--C 1.539 0.53 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.679 173.838 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo . . . . . 0 N--CA 1.458 -0.603 0 N-CA-C 110.714 -0.533 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 40.7 mm -99.53 136.91 28.71 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 -177.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -109.72 -14.24 14.36 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 117.161 -1.4 . . . . 0.0 111.096 172.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 37.3 tp -144.11 131.9 21.36 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 120.603 1.547 . . . . 0.0 110.319 -169.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mp -138.71 117.2 12.07 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 -174.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.4 mp -98.39 111.02 27.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 105.141 -2.17 . . . . 0.0 105.141 173.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.07 151.39 36.91 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 174.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -143.26 142.93 31.53 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 105.408 -2.071 . . . . 0.0 105.408 172.05 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.4 p -135.68 144.24 45.87 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 127.248 2.219 . . . . 0.0 106.498 169.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.8 135.94 22.57 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -175.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -77.98 -22.41 49.43 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.723 0.409 . . . . 0.0 111.803 -177.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -144.05 155.67 44.08 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.011 0.924 . . . . 0.0 110.019 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.09 -34.99 74.23 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -177.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -75.97 -32.11 59.33 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.865 -1.147 . . . . 0.0 110.937 177.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.9 m -62.51 -41.12 98.61 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 169.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 23.4 t60 -58.27 -49.93 75.4 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.027 0.931 . . . . 0.0 110.038 173.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.6 mm -55.94 -54.19 29.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 118.875 0.761 . . . . 0.0 109.568 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.06 -38.77 94.79 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.669 0.668 . . . . 0.0 111.702 -176.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.56 -48.49 60.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.466 1.107 . . . . 0.0 111.1 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.32 -43.55 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 124.489 1.115 . . . . 0.0 108.758 176.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -70.47 -11.11 60.71 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.716 0.806 . . . . 0.0 111.991 -178.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.88 -45.32 12.37 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 169.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.8 mt -71.13 -30.29 66.31 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.742 -0.599 . . . . 0.0 112.042 -173.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.1 m -61.44 -21.1 63.83 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 122.98 0.512 . . . . 0.0 112.076 172.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -68.7 -28.18 66.61 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.608 1.094 . . . . 0.0 110.0 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 40.0 mt -96.66 -63.6 1.12 Allowed 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.0 0.92 . . . . 0.0 111.037 -178.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 17.2 mt -73.38 -1.13 16.9 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -169.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 55.6 m -112.04 27.83 9.3 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.529 1.059 . . . . 0.0 111.357 174.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -141.33 97.66 3.21 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -171.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.87 -26.16 58.15 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.658 0.783 . . . . 0.0 112.371 -173.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -63.43 -46.3 86.95 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.224 0.535 . . . . 0.0 109.79 176.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.54 -43.79 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 C-N-CA 124.427 1.091 . . . . 0.0 109.134 176.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 46.8 mt -56.52 -44.58 80.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 118.945 -0.55 . . . . 0.0 110.976 -173.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -67.04 -38.54 86.07 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 118.152 0.433 . . . . 0.0 110.367 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -67.64 -35.86 79.69 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 118.723 0.692 . . . . 0.0 109.696 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 26.2 mt -70.06 -51.98 27.62 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 173.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 57.4 mt -60.54 -12.03 8.75 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 80.7 p -120.39 8.09 10.75 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.844 1.258 . . . . 0.0 111.321 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.49 114.67 3.08 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.591 1.156 . . . . 0.0 109.782 177.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.8 m -75.5 -20.26 58.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.857 0.863 . . . . 0.0 111.865 178.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.3 m -147.79 157.55 43.59 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.976 0.91 . . . . 0.0 109.939 -169.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -61.01 -38.62 86.72 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.434 1.093 . . . . 0.0 110.522 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -58.61 -36.63 74.32 Favored 'General case' 0 C--O 1.226 -0.178 0 O-C-N 121.946 -0.471 . . . . 0.0 111.389 175.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -68.87 -34.14 74.94 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 123.727 0.811 . . . . 0.0 112.074 177.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 58.6 mt -67.28 -45.46 76.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.733 1.151 . . . . 0.0 107.954 172.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -64.65 -27.08 68.68 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -61.55 -38.84 88.94 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 120.776 -1.203 . . . . 0.0 109.914 174.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 80.1 mt -72.37 -34.99 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 124.514 1.125 . . . . 0.0 109.221 -179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 36.3 mm -56.45 -51.76 60.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 169.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.6 m -65.57 -29.59 70.22 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.987 -170.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -61.51 -30.15 70.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.495 1.918 . . . . 0.0 112.569 172.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.006 0 CA-C-O 117.931 -1.483 . . . . 0.0 110.435 -172.357 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 ttt . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.14 112.78 1.3 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.889 0.376 . . . . 0.0 111.792 171.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.2 -34.38 68.46 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 123.359 0.664 . . . . 0.0 109.876 169.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -59.9 -12.29 7.37 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.189 1.396 . . . . 0.0 113.166 176.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -87.09 -32.22 20.05 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.618 1.099 . . . . 0.0 112.957 171.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -86.35 -43.81 12.58 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 122.794 0.438 . . . . 0.0 110.413 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -86.66 119.25 71.2 Favored Pre-proline 0 CA--C 1.551 1.013 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 -178.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -82.66 -97.72 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.866 3.044 . . . . 0.0 112.225 -169.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -151.66 163.27 39.48 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.836 2.054 . . . . 0.0 106.756 173.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m 57.37 14.51 2.21 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.7 1.6 . . . . 0.0 112.226 -169.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.2 p -103.27 19.99 18.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.535 2.334 . . . . 0.0 112.354 -168.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.8 mt -133.74 141.35 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 169.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.8 m -156.93 149.45 23.34 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 169.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.7 t -113.48 133.56 59.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 103.793 -2.669 . . . . 0.0 103.793 169.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.2 mt -131.67 147.68 32.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -169.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.417 ' C ' ' HG ' ' A' ' 17' ' ' SER . 72.9 t60 -67.81 -44.64 76.82 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.814 -0.554 . . . . 0.0 110.604 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.417 ' HG ' ' C ' ' A' ' 16' ' ' HIS . 4.7 m -165.47 148.55 7.95 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 -176.136 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.71 148.56 34.88 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 171.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.34 -37.48 83.47 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.109 0.564 . . . . 0.0 110.703 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -164.05 -179.21 6.06 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 127.078 2.151 . . . . 0.0 106.805 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 39.4 p-90 -66.48 -33.81 76.52 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 121.584 -0.698 . . . . 0.0 111.812 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.453 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 49.2 mt-30 -54.52 -51.08 66.29 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 169.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.37 -31.78 72.77 Favored 'General case' 0 C--O 1.222 -0.382 0 O-C-N 121.842 -0.536 . . . . 0.0 111.411 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.8 87.55 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 121.853 -0.529 . . . . 0.0 109.812 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.4 -45.68 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -57.92 -45.59 86.31 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.981 0.512 . . . . 0.0 110.423 -174.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -66.68 -32.26 73.46 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.778 -1.106 . . . . 0.0 111.815 173.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.3 m -61.42 -24.89 66.84 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 120.023 1.283 . . . . 0.0 111.675 173.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 9.3 mmt -120.13 -19.81 7.62 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -169.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.8 p -61.03 -34.15 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 CA-C-N 121.571 1.987 . . . . 0.0 112.212 -171.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.4 m -64.78 -30.11 71.11 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.245 0.929 . . . . 0.0 111.354 178.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.2 mt -74.57 -44.26 51.74 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.97 0.908 . . . . 0.0 108.584 172.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.4 tp -56.76 -40.17 75.34 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.881 0.872 . . . . 0.0 110.96 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -66.64 -30.59 70.89 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.116 1.367 . . . . 0.0 113.049 -173.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -98.81 14.71 27.86 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.001 0.364 . . . . 0.0 110.764 172.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.454 0.0 OUTLIER 44.9 43.62 7.22 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.183 2.193 . . . . 0.0 115.357 -169.636 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.424 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 30.6 m-85 -66.44 -19.75 65.88 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.509 -0.745 . . . . 0.0 109.489 168.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.1 pt -143.91 171.2 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 127.152 2.181 . . . . 0.0 108.585 -176.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.0 m -103.78 159.22 15.82 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.065 1.746 . . . . 0.0 107.52 169.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -59.87 -32.44 70.71 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.113 -0.992 . . . . 0.0 111.623 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -57.51 -34.96 69.65 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.12 0.568 . . . . 0.0 112.0 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -59.78 -40.84 89.61 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.72 0.808 . . . . 0.0 110.643 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.2 mt -63.73 -49.88 80.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.426 1.09 . . . . 0.0 108.599 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -66.14 -28.5 68.84 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 118.59 -0.719 . . . . 0.0 112.479 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.19 -43.16 78.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 118.82 0.736 . . . . 0.0 110.684 173.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 52.2 mt -69.26 -47.16 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.453 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.6 mttt -62.43 -43.87 97.78 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.373 0.533 . . . . 0.0 111.051 -173.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -66.61 -40.85 89.03 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.237 1.015 . . . . 0.0 110.757 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 18.3 m -63.98 -34.5 78.12 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.938 -0.476 . . . . 0.0 110.415 174.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 92.3 m . . . . . 0 CA--C 1.537 0.446 0 C-N-CA 123.752 0.821 . . . . 0.0 110.805 175.844 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 . . . . . 0 N--CA 1.462 0.169 0 CA-C-O 119.853 -0.118 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.1 mm -127.13 137.29 58.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 172.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -121.54 -31.17 4.08 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.309 0.644 . . . . 0.0 111.55 -170.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.56 160.1 27.95 Favored Pre-proline 0 C--O 1.236 0.343 0 C-N-CA 125.443 1.497 . . . . 0.0 107.046 176.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -50.92 113.31 1.03 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.53 2.153 . . . . 0.0 109.66 169.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 101.52 -6.19 55.2 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-O 117.528 -1.707 . . . . 0.0 114.538 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.4 t -130.45 127.49 62.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 120.036 1.918 . . . . 0.0 110.051 -169.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.62 166.33 16.91 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 126.214 1.805 . . . . 0.0 109.899 176.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.0 ttm -140.53 60.33 13.64 Favored Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 176.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 141.0 59.21 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.824 1.683 . . . . 0.0 113.755 -171.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -177.02 153.88 1.03 Allowed 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 128.537 2.735 . . . . 0.0 106.176 -170.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.82 160.52 38.3 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 126.41 1.884 . . . . 0.0 107.46 172.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.3 mtm105 -55.32 143.89 53.92 Favored Pre-proline 0 CA--C 1.535 0.398 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.838 177.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -45.94 -41.36 20.56 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.721 2.947 . . . . 0.0 113.335 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -61.77 -13.53 24.39 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.052 1.341 . . . . 0.0 113.288 -176.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 62.6 m -76.3 -3.99 39.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.463 0.705 . . . . 0.0 111.785 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.92 18.19 2.16 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.236 -1.313 . . . . 0.0 112.941 175.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.55 147.1 53.97 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 119.529 1.665 . . . . 0.0 109.107 169.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.4 mt -129.71 -29.74 2.12 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.356 1.062 . . . . 0.0 111.045 -173.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.424 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 87.9 mttt -143.58 157.78 44.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 125.707 1.603 . . . . 0.0 107.739 175.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.7 m -88.84 126.09 35.21 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.79 -178.4 39.79 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.019 0.819 . . . . 0.0 111.793 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 50.2 mtp -143.77 169.22 18.18 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 125.37 1.468 . . . . 0.0 111.132 -176.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.1 m -155.61 162.96 40.53 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.861 1.264 . . . . 0.0 109.444 169.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 mp -124.92 136.45 53.78 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 128.108 2.563 . . . . 0.0 107.141 -177.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 88.0 m -134.28 136.29 43.45 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 175.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.2 tp -129.06 144.59 51.24 Favored 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 123.346 0.404 . . . . 0.0 110.248 171.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -114.24 143.48 44.77 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.139 1.375 . . . . 0.0 109.735 174.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -74.95 -33.31 61.92 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 168.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -125.43 94.91 4.28 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.567 1.947 . . . . 0.0 107.324 174.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -56.81 162.35 7.06 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.188 0.899 . . . . 0.0 112.589 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 92.7 t -130.78 145.99 34.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 -173.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -105.21 172.27 6.88 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.733 0.813 . . . . 0.0 109.374 -174.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 CA--C 1.535 0.379 0 C-N-CA 124.718 1.207 . . . . 0.0 113.202 -169.385 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo . . . . . 0 N--CA 1.449 -1.137 0 N-CA-C 110.58 -0.584 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 39.9 mm -105.36 123.85 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -91.08 -22.63 20.63 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.291 -1.337 . . . . 0.0 111.043 170.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 40.7 tp -132.07 128.7 38.77 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.293 1.406 . . . . 0.0 110.649 -169.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.4 mp -132.02 138.05 48.07 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -178.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 6.0 mt -123.43 107.53 19.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -71.23 147.99 43.47 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 174.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -144.57 135.45 24.93 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 169.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.9 p -129.4 148.28 51.3 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 125.751 1.62 . . . . 0.0 106.793 168.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.84 133.24 21.85 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 118.88 0.764 . . . . 0.0 109.568 -177.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.71 -20.09 61.28 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.892 0.477 . . . . 0.0 111.878 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -147.58 152.62 38.25 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.381 1.072 . . . . 0.0 109.364 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.86 -32.87 71.09 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -175.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -77.9 -30.45 50.7 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 119.416 1.007 . . . . 0.0 111.32 178.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 7.9 m -64.76 -37.17 86.7 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.739 -0.6 . . . . 0.0 109.983 169.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -47.07 86.55 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 124.063 0.945 . . . . 0.0 110.185 170.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.5 mm -58.37 -49.45 81.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -57.39 -41.68 93.31 Favored Glycine 0 CA--C 1.532 1.103 0 CA-C-N 118.97 0.805 . . . . 0.0 111.924 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.28 -45.67 65.86 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.524 0.73 . . . . 0.0 111.213 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.0 mm -55.08 -46.71 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 124.86 1.264 . . . . 0.0 108.02 174.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -68.41 -9.87 51.35 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.422 1.089 . . . . 0.0 112.348 -177.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -95.95 -43.22 7.91 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 124.593 1.157 . . . . 0.0 110.834 171.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 4.4 pp -76.05 -26.62 56.73 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 118.376 0.534 . . . . 0.0 111.407 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.6 p -59.4 -21.98 60.73 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.089 173.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -65.61 -20.4 66.3 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.137 0.881 . . . . 0.0 110.182 172.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 23.1 mt -102.2 -60.86 1.47 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.319 1.447 . . . . 0.0 111.037 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.79 -31.9 68.83 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.986 1.314 . . . . 0.0 113.802 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 59.6 m -104.58 26.74 8.67 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 118.641 0.655 . . . . 0.0 110.74 -174.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -132.29 97.9 4.25 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.0 -28.11 55.77 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.572 0.749 . . . . 0.0 112.263 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -65.61 -44.02 87.85 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.07 0.548 . . . . 0.0 110.142 176.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.64 -42.54 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 123.595 0.758 . . . . 0.0 108.998 175.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 62.2 mt -55.24 -43.87 74.98 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-O 118.711 -0.662 . . . . 0.0 110.595 -177.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -65.96 -40.8 91.62 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 118.605 0.639 . . . . 0.0 110.787 178.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -69.97 -29.0 66.0 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.504 0.593 . . . . 0.0 110.877 -175.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 34.5 mt -75.77 -52.73 9.78 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.942 0.897 . . . . 0.0 109.195 169.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 38.5 mt -57.61 -20.66 34.35 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.97 0.908 . . . . 0.0 113.294 -176.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 76.4 p -114.25 10.85 17.3 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.679 1.192 . . . . 0.0 111.249 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.98 110.92 1.48 Allowed 'General case' 0 C--N 1.344 0.35 0 C-N-CA 124.167 0.987 . . . . 0.0 110.287 -179.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 10.5 m -74.67 -10.84 59.91 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.567 0.747 . . . . 0.0 112.157 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 3.6 p -158.1 152.64 24.72 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.997 0.817 . . . . 0.0 108.997 -172.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -59.26 -34.96 72.87 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.634 1.174 . . . . 0.0 110.774 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -35.21 60.15 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 124.561 1.144 . . . . 0.0 113.819 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -73.14 -34.92 66.38 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 123.447 0.699 . . . . 0.0 110.173 -177.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 mp -61.9 -46.31 89.93 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-N 119.978 1.263 . . . . 0.0 109.019 172.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.71 -29.93 71.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.479 0.712 . . . . 0.0 112.637 177.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -68.63 -44.85 73.35 Favored 'General case' 0 C--N 1.332 -0.163 0 O-C-N 121.169 -0.957 . . . . 0.0 110.421 174.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 68.8 mt -62.34 -38.58 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 C-N-CA 124.229 1.011 . . . . 0.0 109.884 177.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 12.7 mm -55.79 -56.15 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.062 0 C-N-CA 123.722 0.809 . . . . 0.0 109.289 169.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 40.7 m -64.36 -26.46 68.48 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.887 0.475 . . . . 0.0 111.279 -170.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -58.94 -27.88 65.72 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.836 1.654 . . . . 0.0 113.362 173.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.936 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 -173.957 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.2 tpp . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.96 114.52 3.12 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 168.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -56.92 -43.57 81.55 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.978 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.97 -26.37 14.99 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.407 1.483 . . . . 0.0 112.955 -176.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -59.43 -28.55 67.05 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 118.888 0.767 . . . . 0.0 111.971 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -91.21 -12.56 34.94 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 117.545 -1.217 . . . . 0.0 112.859 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -114.02 85.66 10.35 Favored Pre-proline 0 N--CA 1.473 0.703 0 CA-C-N 121.607 2.003 . . . . 0.0 107.832 -173.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -57.92 -53.64 4.15 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.224 2.616 . . . . 0.0 116.412 -169.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.552 ' C ' ' H ' ' A' ' 11' ' ' SER . 41.6 tt0 -159.64 -88.3 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.041 0.837 . . . . 0.0 113.191 -169.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.9 m -68.77 16.23 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.884 1.674 . . . . 0.0 111.162 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.552 ' H ' ' C ' ' A' ' 9' ' ' GLU . 8.7 m -76.92 10.08 2.51 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 128.174 2.589 . . . . 0.0 112.785 -168.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.6 mm -139.4 130.11 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 N-CA-C 104.071 -2.566 . . . . 0.0 104.071 -171.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.6 m -157.24 136.39 11.86 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 119.625 1.102 . . . . 0.0 110.621 171.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.6 p -106.03 139.66 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 168.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.8 mt -135.89 143.86 35.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 124.255 1.022 . . . . 0.0 108.315 -168.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 39.6 m80 -67.95 -35.22 78.02 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.925 0.49 . . . . 0.0 111.959 177.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -174.42 144.23 0.89 Allowed 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.201 1.8 . . . . 0.0 106.431 176.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.3 150.24 30.04 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 169.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -59.41 -41.29 89.16 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.127 0.571 . . . . 0.0 110.977 -178.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -167.16 -176.24 3.25 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 126.531 1.933 . . . . 0.0 108.052 172.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 24.1 p-90 -68.69 -30.73 69.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.897 0.771 . . . . 0.0 112.817 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.471 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.0 mt-30 -60.83 -47.51 86.01 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 171.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.87 -35.71 79.12 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 121.201 -0.937 . . . . 0.0 111.666 176.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.0 -34.07 77.17 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.881 -0.512 . . . . 0.0 110.65 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.72 -46.52 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 171.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -56.46 -46.59 80.3 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 118.227 0.467 . . . . 0.0 110.331 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -62.98 -34.34 77.33 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 117.98 -1.01 . . . . 0.0 111.561 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.2 m -63.85 -21.72 66.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.937 1.244 . . . . 0.0 112.484 174.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.0 mmt -123.51 -17.58 6.44 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -169.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -58.25 -35.4 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 120.3 1.409 . . . . 0.0 112.399 -169.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 m -60.48 -36.19 77.7 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 119.217 0.917 . . . . 0.0 110.819 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.6 mt -78.62 -40.44 34.33 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.152 0.981 . . . . 0.0 109.199 178.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 43.0 tp -56.99 -40.97 77.55 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.337 0.517 . . . . 0.0 110.24 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -68.11 -32.44 72.75 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 124.733 1.213 . . . . 0.0 113.252 -172.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -96.68 17.89 15.49 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.31 0.505 . . . . 0.0 110.672 172.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.43 0.0 OUTLIER 44.18 40.85 3.83 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.579 2.351 . . . . 0.0 115.979 -171.27 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -66.71 -20.4 65.96 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.195 -0.941 . . . . 0.0 109.372 167.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.7 pt -143.57 168.87 11.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 C-N-CA 126.928 2.091 . . . . 0.0 108.419 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 64.4 p -101.13 165.88 11.07 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.831 1.252 . . . . 0.0 108.889 169.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.4 -30.29 70.46 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.266 -0.897 . . . . 0.0 111.86 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -59.46 -33.68 71.59 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 121.931 -0.481 . . . . 0.0 111.604 177.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -59.84 -41.68 91.92 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.344 0.658 . . . . 0.0 111.199 -177.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.6 mp -59.26 -49.51 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -67.36 -29.17 68.64 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 121.61 -0.681 . . . . 0.0 112.757 -178.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.11 -43.48 78.19 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.688 0.676 . . . . 0.0 110.907 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 51.1 mt -69.36 -44.75 80.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 178.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.8 mttt -63.22 -41.08 99.08 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.611 -0.681 . . . . 0.0 111.077 -176.197 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.16 -39.61 94.36 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.316 1.046 . . . . 0.0 110.623 176.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.0 m -62.59 -36.86 84.05 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.996 -0.44 . . . . 0.0 110.539 172.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 23.9 m . . . . . 0 CA--C 1.537 0.478 0 C-N-CA 123.479 0.712 . . . . 0.0 110.39 177.95 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 . . . . . 0 N--CA 1.449 -0.514 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.6 mm -133.16 140.38 47.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -114.84 -31.62 6.06 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.025 0.53 . . . . 0.0 111.164 175.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -156.45 158.56 31.5 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 125.469 1.508 . . . . 0.0 107.376 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.12 124.09 9.76 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.473 2.115 . . . . 0.0 110.104 169.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.66 -0.08 88.01 Favored Glycine 0 CA--C 1.537 1.417 0 CA-C-O 117.791 -1.561 . . . . 0.0 115.077 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.3 t -127.78 111.08 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 119.986 1.893 . . . . 0.0 108.033 -176.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -107.74 167.65 9.82 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 123.881 0.872 . . . . 0.0 110.027 174.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.4 ttm -141.05 61.58 14.68 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 176.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -52.17 143.04 43.57 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 121.901 1.734 . . . . 0.0 113.902 -171.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -178.4 154.33 0.8 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 128.472 2.709 . . . . 0.0 106.388 -170.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -136.65 153.28 50.96 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.961 1.704 . . . . 0.0 107.621 169.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 38.2 mtm105 -53.56 143.16 38.81 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.33 -178.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -45.5 -43.17 18.05 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.901 3.067 . . . . 0.0 114.145 -171.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.2 -13.53 18.81 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.687 1.195 . . . . 0.0 113.975 -177.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.1 m -75.88 -7.15 53.85 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.774 0.83 . . . . 0.0 111.954 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 135.75 14.21 1.03 Allowed Glycine 0 CA--C 1.525 0.705 0 CA-C-O 118.434 -1.203 . . . . 0.0 113.547 177.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.87 144.79 52.41 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 119.904 1.852 . . . . 0.0 109.304 169.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.5 mt -129.68 -32.71 1.89 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 124.854 1.261 . . . . 0.0 110.479 -173.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -143.39 164.76 29.38 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 126.149 1.78 . . . . 0.0 107.968 174.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.6 m -97.07 130.94 44.3 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 123.218 0.607 . . . . 0.0 110.587 -178.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.46 -179.07 45.77 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 124.954 1.264 . . . . 0.0 110.737 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 47.1 mtt -143.9 171.09 14.71 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 126.46 1.904 . . . . 0.0 110.706 -175.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.85 161.7 41.3 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 126.427 1.891 . . . . 0.0 107.872 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.3 tp -141.54 117.56 10.57 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.336 1.855 . . . . 0.0 107.274 -172.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 69.6 m -123.37 141.72 51.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.9 tp -133.25 146.35 51.34 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 171.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.17 135.61 53.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.368 1.067 . . . . 0.0 108.573 174.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.05 -40.55 87.14 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 168.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -123.06 94.01 4.13 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.758 2.023 . . . . 0.0 106.825 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -53.93 160.98 4.02 Favored Glycine 0 CA--C 1.526 0.754 0 C-N-CA 124.885 1.231 . . . . 0.0 113.491 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.0 t -123.73 149.87 27.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 -179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -112.21 108.64 17.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.079 0.466 . . . . 0.0 111.832 -167.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 169.147 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo . . . . . 0 N--CA 1.46 -0.453 0 CA-C-O 120.819 0.258 . . . . 0.0 111.809 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 26.4 mm -72.79 128.55 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 175.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -104.74 -15.38 15.25 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 117.239 -1.363 . . . . 0.0 111.134 170.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 48.9 tp -141.1 132.11 26.16 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 120.467 1.485 . . . . 0.0 109.645 -171.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.8 mp -137.47 132.43 33.32 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 3.0 mt -112.94 117.21 54.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 168.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.51 147.41 35.62 Favored Glycine 0 N--CA 1.443 -0.852 0 N-CA-C 108.465 -1.854 . . . . 0.0 108.465 169.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -141.95 138.65 32.11 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 103.277 -2.86 . . . . 0.0 103.277 169.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.2 m -140.71 143.99 35.34 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 169.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.23 136.96 26.98 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 118.399 0.545 . . . . 0.0 109.734 -169.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.92 -22.05 59.82 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.03 0.532 . . . . 0.0 112.097 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -146.31 155.54 42.71 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.973 0.909 . . . . 0.0 109.758 -178.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.43 74.29 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -177.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.59 -31.58 62.08 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 120.807 -1.183 . . . . 0.0 110.946 177.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.7 m -64.49 -39.33 93.6 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.993 -0.442 . . . . 0.0 110.161 170.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.9 t60 -58.8 -48.84 79.87 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 123.541 0.737 . . . . 0.0 110.054 171.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 12.2 mm -56.01 -53.02 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.472 0.709 . . . . 0.0 109.168 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.24 -39.35 94.47 Favored Glycine 0 CA--C 1.529 0.966 0 CA-C-N 118.931 0.787 . . . . 0.0 111.929 -177.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.84 -53.48 21.18 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.506 1.122 . . . . 0.0 110.64 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.3 mm -49.89 -47.54 22.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 125.746 1.619 . . . . 0.0 108.883 173.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -67.72 -10.95 57.02 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.427 -0.795 . . . . 0.0 112.384 -177.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.35 -48.33 6.72 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.146 0.979 . . . . 0.0 109.509 170.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.9 pp -70.33 -22.73 62.77 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -176.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 44.2 m -63.18 -23.24 67.34 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 123.522 0.729 . . . . 0.0 111.475 173.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -66.84 -17.45 64.89 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.522 -0.736 . . . . 0.0 110.122 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 38.0 mt -108.1 -61.87 1.52 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.822 1.249 . . . . 0.0 110.951 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 72.8 mt -69.63 -8.62 49.14 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.21 1.404 . . . . 0.0 114.206 -173.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.1 m -120.09 27.68 8.51 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.843 0.857 . . . . 0.0 110.64 175.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -131.44 101.62 5.6 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 125.316 1.446 . . . . 0.0 107.515 176.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -56.8 -27.62 60.13 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.657 0.783 . . . . 0.0 112.217 -177.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -63.13 -48.53 78.12 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 123.465 0.706 . . . . 0.0 109.789 176.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.28 -43.26 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 C-N-CA 123.945 0.898 . . . . 0.0 109.016 177.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 47.5 mt -55.73 -43.2 76.34 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.989 -175.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -66.99 -38.9 86.87 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.479 0.581 . . . . 0.0 110.711 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -70.97 -34.7 71.68 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 118.78 0.718 . . . . 0.0 109.863 -175.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 35.1 mt -67.91 -54.35 19.49 Favored 'General case' 0 C--O 1.224 -0.27 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 170.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.5 mt -56.57 -23.61 41.59 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -175.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 69.6 p -109.45 5.62 23.51 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.434 1.093 . . . . 0.0 111.876 -178.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.03 106.33 0.82 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 124.271 1.028 . . . . 0.0 110.68 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.5 p -75.55 -1.86 26.38 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.033 1.333 . . . . 0.0 112.999 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 21.4 p -149.78 155.4 40.05 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.04 0.936 . . . . 0.0 110.714 -177.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -58.62 -39.28 80.03 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.506 1.122 . . . . 0.0 109.577 173.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -34.26 74.93 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.06 -178.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -63.17 -44.14 96.3 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.603 0.638 . . . . 0.0 110.941 174.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.6 mt -63.54 -49.07 74.9 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.56 -35.13 71.87 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 173.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -66.74 -43.09 85.11 Favored 'General case' 0 C--N 1.331 -0.197 0 O-C-N 120.962 -1.086 . . . . 0.0 109.86 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 82.9 mt -66.75 -35.16 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 C-N-CA 123.661 0.784 . . . . 0.0 109.199 179.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.1 mm -58.54 -53.14 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 169.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 25.3 m -63.0 -28.76 70.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 122.747 0.419 . . . . 0.0 111.61 -171.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -60.01 -28.28 67.59 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 126.212 1.805 . . . . 0.0 113.565 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.869 0 CA-C-O 117.935 -1.481 . . . . 0.0 109.5 -173.245 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.222 0.058 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -66.21 110.21 2.93 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 173.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -59.46 -32.63 70.41 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 171.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.58 -18.47 11.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.103 0.961 . . . . 0.0 112.443 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -66.09 -22.45 66.4 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 118.883 0.765 . . . . 0.0 112.772 176.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -102.76 -4.85 24.38 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 117.039 -1.458 . . . . 0.0 114.215 -169.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -116.16 88.07 21.43 Favored Pre-proline 0 N--CA 1.475 0.815 0 CA-C-N 122.116 2.234 . . . . 0.0 109.245 -170.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_exo -40.65 -73.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.808 1 C-N-CA 125.723 4.282 . . . . 0.0 116.448 -174.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.482 ' C ' ' H ' ' A' ' 11' ' ' SER . 37.2 tt0 -163.32 -76.72 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.832 0.853 . . . . 0.0 111.252 -171.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.67 6.8 0.58 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.774 1.63 . . . . 0.0 111.914 175.336 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.482 ' H ' ' C ' ' A' ' 9' ' ' GLU . 3.5 m -73.94 -0.85 17.43 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.571 2.348 . . . . 0.0 113.626 -168.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.6 mt -133.48 134.5 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 -169.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.7 m -156.41 151.71 26.62 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.496 0.718 . . . . 0.0 110.939 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.9 t -118.74 142.22 34.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 169.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.41 HG22 ' H ' ' A' ' 17' ' ' SER . 15.3 mt -139.41 147.69 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.227 1.811 . . . . 0.0 106.216 -171.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -68.65 -45.54 71.5 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.231 -0.918 . . . . 0.0 110.375 169.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -170.6 145.95 2.63 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.918 1.687 . . . . 0.0 106.455 -177.861 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.29 159.22 27.32 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 174.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt -59.09 -35.7 73.86 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.404 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -164.6 -179.28 5.84 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 127.328 2.251 . . . . 0.0 106.8 170.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 41.8 p-90 -64.97 -33.78 76.86 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.209 -0.932 . . . . 0.0 112.194 171.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.42 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 48.8 mt-30 -55.27 -45.23 76.15 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.75 1.22 . . . . 0.0 108.485 170.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -71.04 -33.56 70.41 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 121.23 -0.919 . . . . 0.0 110.817 177.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.42 -35.08 79.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 121.573 -0.704 . . . . 0.0 110.786 -178.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.94 -47.07 86.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 170.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.46 -42.24 82.13 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 118.469 0.577 . . . . 0.0 110.604 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -64.68 -33.1 75.16 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.167 0.987 . . . . 0.0 111.614 173.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.9 m -67.16 -17.97 65.07 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.831 1.196 . . . . 0.0 112.03 173.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.1 mmt -125.57 -23.48 4.06 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -168.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 p -60.25 -36.91 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 120.837 1.653 . . . . 0.0 111.684 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.0 m -67.16 -19.54 65.61 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 118.594 0.634 . . . . 0.0 112.119 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 79.9 mt -86.33 -43.46 12.86 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.908 0.883 . . . . 0.0 109.115 169.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 35.8 tp -56.61 -43.2 79.94 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.92 0.888 . . . . 0.0 110.66 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -67.65 -23.49 65.34 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 125.865 1.666 . . . . 0.0 113.931 -171.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -114.49 26.1 10.5 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.057 0.389 . . . . 0.0 110.592 171.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 60.82 26.38 16.22 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 170.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -66.97 -23.05 65.9 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.165 -0.959 . . . . 0.0 110.647 169.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.5 pt -142.06 179.61 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 126.702 2.001 . . . . 0.0 107.975 178.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.8 p -123.17 162.65 22.13 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.816 1.646 . . . . 0.0 108.727 170.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.05 -31.68 67.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.06 0.944 . . . . 0.0 113.076 -169.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -60.16 -33.5 72.27 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.746 -0.596 . . . . 0.0 111.794 177.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -59.48 -41.51 89.97 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.722 0.809 . . . . 0.0 110.647 -177.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.12 -52.09 64.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 123.446 0.699 . . . . 0.0 109.552 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -68.9 -26.84 65.3 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -176.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.71 -41.37 73.71 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.024 0.829 . . . . 0.0 111.03 173.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 33.5 mt -70.29 -45.65 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.5 mttt -66.64 -39.9 88.47 Favored 'General case' 0 C--O 1.224 -0.266 0 O-C-N 121.989 -0.444 . . . . 0.0 111.445 -175.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.45 -41.43 98.73 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.24 1.016 . . . . 0.0 110.301 178.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -64.83 -40.85 95.84 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.411 0.684 . . . . 0.0 110.508 173.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 27.8 m . . . . . 0 CA--C 1.54 0.579 0 O-C-N 121.606 -0.684 . . . . 0.0 111.2 174.661 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 . . . . . 0 N--CA 1.454 -0.231 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.5 mm -138.24 134.19 44.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 104.77 -2.308 . . . . 0.0 104.77 -174.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -123.71 -28.5 3.84 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 123.468 0.707 . . . . 0.0 111.261 -169.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.22 162.91 23.16 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 125.717 1.607 . . . . 0.0 107.322 175.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.1 117.98 3.22 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.694 2.263 . . . . 0.0 110.893 169.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.85 1.01 77.42 Favored Glycine 0 CA--C 1.53 0.97 0 CA-C-O 117.931 -1.483 . . . . 0.0 114.064 178.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.3 t -128.9 118.91 48.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 119.803 1.801 . . . . 0.0 108.698 -169.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -121.31 166.89 13.39 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.554 1.542 . . . . 0.0 110.104 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.0 ttm -135.8 60.63 37.1 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 123.166 0.586 . . . . 0.0 110.163 172.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -59.3 121.22 9.54 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 121.946 1.764 . . . . 0.0 110.15 -171.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -172.5 162.49 5.28 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 127.634 2.374 . . . . 0.0 107.173 -169.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.87 172.42 13.04 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.709 1.204 . . . . 0.0 109.867 -174.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -58.5 154.01 36.28 Favored Pre-proline 0 CA--C 1.537 0.467 0 CA-C-O 118.468 -0.777 . . . . 0.0 109.605 173.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.55 -40.03 83.74 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.462 2.108 . . . . 0.0 109.972 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -64.61 -12.59 47.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.402 1.481 . . . . 0.0 112.94 -176.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 80.9 m -77.34 -5.37 49.35 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.777 0.717 . . . . 0.0 111.965 178.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 130.69 18.44 1.41 Allowed Glycine 0 CA--C 1.524 0.607 0 CA-C-O 118.405 -1.219 . . . . 0.0 113.112 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.09 146.07 53.81 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 119.281 1.541 . . . . 0.0 109.026 169.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.8 mt -132.77 -29.47 1.5 Allowed 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 123.973 0.909 . . . . 0.0 111.183 -173.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -147.17 156.15 42.73 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.031 1.332 . . . . 0.0 107.827 177.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 93.7 m -88.28 128.57 35.48 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 123.04 0.536 . . . . 0.0 111.057 -176.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -176.92 -178.8 46.95 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.347 1.451 . . . . 0.0 110.854 -176.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 53.5 mtt -148.57 172.46 14.49 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 127.018 2.127 . . . . 0.0 110.077 -175.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.7 m -152.75 168.21 26.45 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.209 1.403 . . . . 0.0 109.157 169.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.9 tp -145.59 125.51 13.56 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.448 1.899 . . . . 0.0 108.737 -169.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 73.2 m -133.56 145.33 49.99 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.974 1.31 . . . . 0.0 108.296 -176.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.6 tt -136.29 132.77 36.16 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 174.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.2 mp -114.09 121.31 43.44 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 126.865 2.066 . . . . 0.0 106.376 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -60.77 -36.91 80.17 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.247 0.93 . . . . 0.0 112.745 -177.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -92.96 -14.93 26.86 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.286 0.634 . . . . 0.0 112.156 176.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.97 -176.44 21.67 Favored Glycine 0 CA--C 1.534 1.271 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 -168.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.2 p -150.66 164.43 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 O-C-N 121.663 -0.904 . . . . 0.0 108.659 169.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -102.37 110.71 22.74 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.458 0.647 . . . . 0.0 109.837 -169.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 . . . . . 0 CA--C 1.539 0.534 0 C-N-CA 125.594 1.558 . . . . 0.0 108.118 170.148 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo . . . . . 0 N--CA 1.452 -0.966 0 N-CA-C 109.22 -1.108 . . . . 0.0 109.22 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 31.4 mm -72.38 107.74 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 178.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 32.0 mtpt -84.59 -18.86 34.2 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-O 117.094 -1.431 . . . . 0.0 111.513 171.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 8.4 mt -137.97 139.24 39.6 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 120.703 1.592 . . . . 0.0 111.837 -174.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mp -140.7 134.63 30.63 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 -175.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 5.0 mt -119.94 126.49 75.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 169.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.18 153.58 28.01 Favored Glycine 0 CA--C 1.522 0.517 0 N-CA-C 108.834 -1.706 . . . . 0.0 108.834 169.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.99 144.26 25.72 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 105.344 -2.095 . . . . 0.0 105.344 173.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 79.5 p -142.29 146.38 35.01 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 105.565 -2.013 . . . . 0.0 105.565 168.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 77' ' ' THR . . . -144.15 148.17 34.67 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 171.018 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -83.78 -13.85 52.88 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.012 -174.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -135.5 152.53 51.42 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.619 0.768 . . . . 0.0 110.171 174.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.27 -35.23 76.73 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -177.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -72.22 -31.17 65.61 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.09 -1.006 . . . . 0.0 110.808 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.3 m -63.84 -38.82 92.52 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 118.719 -0.658 . . . . 0.0 109.658 169.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 -61.93 -43.33 99.07 Favored 'General case' 0 C--N 1.344 0.345 0 CA-C-N 119.401 1.0 . . . . 0.0 110.767 172.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.8 mm -57.82 -55.57 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 119.428 1.013 . . . . 0.0 109.331 177.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -58.92 -39.32 93.92 Favored Glycine 0 CA--C 1.528 0.849 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.51 -49.05 65.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.308 1.043 . . . . 0.0 111.267 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.4 mm -56.36 -42.95 75.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.231 1.013 . . . . 0.0 108.643 176.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -70.98 -12.35 61.49 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.75 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -82.98 -45.51 14.01 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 169.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 92.5 mt -71.54 -26.94 62.85 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 118.887 -0.578 . . . . 0.0 112.062 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.1 m -60.83 -24.43 65.86 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.096 0.407 . . . . 0.0 111.591 170.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.53 -16.41 62.33 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.748 -1.22 . . . . 0.0 110.688 175.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 42.2 mt -104.52 -67.56 0.9 Allowed 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.322 1.049 . . . . 0.0 109.713 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 16.9 mt -75.48 -6.35 49.71 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -171.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 33.4 m -119.86 29.7 7.42 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.175 0.898 . . . . 0.0 110.457 174.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -131.33 108.5 9.69 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 172.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -57.68 -27.38 62.83 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.632 -177.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -63.78 -45.25 90.6 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.25 0.62 . . . . 0.0 110.003 176.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.54 -41.23 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 118.409 -0.805 . . . . 0.0 109.135 175.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 35.3 mt -56.14 -39.78 72.78 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 119.34 0.973 . . . . 0.0 111.231 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -69.87 -37.33 76.05 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.01 176.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -65.35 -41.44 93.85 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 119.336 0.971 . . . . 0.0 109.106 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 22.9 mt -66.19 -52.85 44.12 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 175.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 51.1 mt -59.37 -17.4 29.66 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 77.6 p -108.24 3.2 23.36 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.629 1.172 . . . . 0.0 112.09 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.45 140.19 58.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.403 1.081 . . . . 0.0 109.257 169.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -132.46 1.84 3.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.028 1.331 . . . . 0.0 111.234 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.2 m -144.28 150.62 38.19 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.115 0.966 . . . . 0.0 109.442 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.2 -43.16 92.25 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.957 1.303 . . . . 0.0 110.649 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -60.02 -35.29 74.76 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 123.054 0.542 . . . . 0.0 111.287 177.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -64.56 -40.34 95.39 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.948 0.899 . . . . 0.0 111.161 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.1 mt -65.61 -46.15 80.4 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.31 69.27 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 174.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -65.57 -38.18 88.81 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 120.52 -1.363 . . . . 0.0 109.913 174.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 66.2 mt -69.55 -35.47 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 C-N-CA 124.141 0.976 . . . . 0.0 109.562 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 27.9 mm -56.26 -50.75 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 169.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 18.7 m -65.12 -30.61 71.55 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 123.281 0.363 . . . . 0.0 110.966 -173.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -60.11 -27.61 67.17 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.218 1.407 . . . . 0.0 113.296 172.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 N-CA-C 108.79 -1.724 . . . . 0.0 108.79 -179.028 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.467 0.175 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.21 109.01 3.38 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 172.145 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -58.36 -31.69 67.85 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.6 -21.1 2.33 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.931 1.692 . . . . 0.0 113.319 177.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -64.02 -25.19 68.01 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.304 0.957 . . . . 0.0 113.468 174.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -101.19 -21.66 14.87 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -169.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -103.97 103.99 40.76 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 -170.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -59.19 -68.04 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.511 2.807 . . . . 0.0 113.968 -171.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.448 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.6 tp10 -163.28 -74.73 0.04 OUTLIER 'General case' 0 CA--C 1.521 -0.164 0 C-N-CA 124.155 0.982 . . . . 0.0 111.028 -173.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.13 3.11 1.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.104 1.362 . . . . 0.0 111.917 177.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.448 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -66.83 -15.28 63.5 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.815 1.646 . . . . 0.0 113.24 -169.651 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.4 mp -117.83 137.27 52.3 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 -171.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.1 m -156.97 139.86 15.26 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.572 0.624 . . . . 0.0 110.917 176.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 92.7 t -105.0 137.11 35.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 104.764 -2.31 . . . . 0.0 104.764 169.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.403 HG21 ' H ' ' A' ' 17' ' ' SER . 40.9 mt -137.74 148.81 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 -176.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -66.05 -45.82 79.99 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.584 -0.697 . . . . 0.0 110.733 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.403 ' H ' HG21 ' A' ' 15' ' ' ILE . 5.1 p -164.9 144.39 6.98 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.815 1.246 . . . . 0.0 108.144 -176.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.23 156.75 28.0 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 169.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -60.05 -40.92 91.07 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.576 176.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -167.41 -177.49 3.63 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 128.201 2.6 . . . . 0.0 107.505 171.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -62.17 -34.15 75.88 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.451 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.5 mt-30 -60.66 -48.43 81.81 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.578 1.535 . . . . 0.0 107.906 173.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -62.64 -35.86 80.96 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 121.307 -0.871 . . . . 0.0 111.451 176.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.93 82.4 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.766 -0.584 . . . . 0.0 110.544 -178.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -65.64 -47.89 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 172.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -58.44 -48.02 82.08 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 118.434 0.561 . . . . 0.0 110.762 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -59.7 -30.01 68.49 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.287 1.035 . . . . 0.0 111.356 174.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 31.5 m -84.58 -9.91 57.87 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 119.383 0.992 . . . . 0.0 113.565 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.2 mmt -124.72 -21.52 4.78 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 119.99 1.268 . . . . 0.0 112.757 -172.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.22 -37.28 55.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 120.489 1.495 . . . . 0.0 111.125 -175.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 m -64.48 -25.71 68.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.598 -0.689 . . . . 0.0 112.425 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.6 mt -87.51 -40.98 13.83 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.127 0.971 . . . . 0.0 109.061 175.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.2 tp -56.15 -41.72 75.84 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.563 1.145 . . . . 0.0 110.4 176.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.67 -32.64 74.31 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 125.426 1.49 . . . . 0.0 112.673 -174.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.3 mmtt -94.69 15.84 17.21 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.217 0.462 . . . . 0.0 110.818 173.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.33 3.5 p30 46.89 42.57 12.36 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.889 1.675 . . . . 0.0 114.079 -172.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -69.88 -21.84 63.29 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.501 -0.749 . . . . 0.0 109.324 168.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.6 pt -147.12 170.43 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 127.096 2.158 . . . . 0.0 108.159 -174.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.8 p -105.85 168.13 9.32 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.039 1.336 . . . . 0.0 109.187 169.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.89 -30.06 71.18 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.254 -0.904 . . . . 0.0 111.997 -175.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -60.59 -32.55 71.65 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 121.788 -0.57 . . . . 0.0 111.474 175.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -59.88 -43.42 94.74 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.539 0.609 . . . . 0.0 110.563 -177.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.1 mp -55.33 -50.11 67.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 123.315 0.646 . . . . 0.0 109.365 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -71.43 -25.38 62.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.665 -0.683 . . . . 0.0 111.923 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.58 -43.82 97.85 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 119.434 1.015 . . . . 0.0 110.801 173.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.4 mt -63.99 -45.41 96.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.451 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.8 mttt -61.62 -37.98 85.96 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 122.042 -0.411 . . . . 0.0 110.229 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.45 -43.49 94.1 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 119.083 0.856 . . . . 0.0 111.33 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 49.4 m -59.12 -38.75 80.34 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.753 0.706 . . . . 0.0 110.611 171.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.5 m . . . . . 0 CA--C 1.539 0.524 0 C-N-CA 123.564 0.746 . . . . 0.0 111.064 178.194 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.231 0.108 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.5 mm -141.01 134.54 31.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 103.114 -2.921 . . . . 0.0 103.114 -178.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mp -130.62 -21.2 2.82 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -169.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.29 160.43 30.45 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 172.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -57.67 121.36 9.89 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 121.927 1.751 . . . . 0.0 109.565 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.54 2.53 76.08 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-O 117.895 -1.503 . . . . 0.0 114.445 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.7 t -133.39 118.67 32.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-N 120.312 2.056 . . . . 0.0 109.275 -169.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -116.19 163.35 16.1 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.362 1.465 . . . . 0.0 109.818 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 7.5 ttm -137.79 61.08 27.54 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-O 118.59 -0.719 . . . . 0.0 109.862 171.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . 0.28 93.7 Cg_exo -31.22 -85.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.016 1 C-N-CA 125.786 4.324 . . . . 0.0 118.763 -168.305 . . . . . . . . 3 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 54.72 164.13 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 126.905 2.082 . . . . 0.0 114.61 -176.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -141.97 155.87 45.46 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 126.478 1.911 . . . . 0.0 106.916 170.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -50.86 147.75 8.31 Favored Pre-proline 0 CA--C 1.536 0.42 0 CA-C-O 118.08 -0.962 . . . . 0.0 110.034 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_exo -46.68 -41.97 24.18 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.217 2.611 . . . . 0.0 112.876 176.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -61.6 -14.28 29.1 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.799 1.24 . . . . 0.0 113.842 -177.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.2 m -79.84 -3.08 46.31 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.712 0.805 . . . . 0.0 112.247 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.66 18.92 1.72 Allowed Glycine 0 C--N 1.336 0.562 0 CA-C-O 118.748 -1.029 . . . . 0.0 112.959 175.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.4 148.67 49.29 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 119.468 1.634 . . . . 0.0 109.269 170.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 76.5 mt -131.9 -32.25 1.45 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 124.828 1.251 . . . . 0.0 110.77 -175.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -143.31 163.15 33.79 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.942 1.697 . . . . 0.0 107.816 178.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.3 m -97.71 122.62 41.01 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 123.189 0.596 . . . . 0.0 109.91 -177.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -168.88 179.83 41.44 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.25 1.405 . . . . 0.0 111.348 -176.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 52.1 mtt -149.02 168.34 23.39 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.44 1.496 . . . . 0.0 111.23 -170.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.2 p -148.54 164.91 32.8 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.454 1.502 . . . . 0.0 109.852 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.1 tp -146.28 90.03 1.92 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.602 1.561 . . . . 0.0 109.923 -169.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.1 m -97.45 143.75 27.86 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.0 tp -133.25 136.78 45.76 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 169.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -115.69 116.34 27.91 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 104.705 -2.331 . . . . 0.0 104.705 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.42 -33.44 75.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 118.701 0.682 . . . . 0.0 112.328 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -85.48 -13.43 49.14 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.919 0.888 . . . . 0.0 111.722 173.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 68.75 177.23 13.7 Favored Glycine 0 CA--C 1.533 1.181 0 N-CA-C 110.265 -1.134 . . . . 0.0 110.265 -168.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -146.12 161.15 10.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 168.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.95 103.0 11.96 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 121.409 -0.807 . . . . 0.0 110.024 -169.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 . . . . . 0 CA--C 1.538 0.497 0 CA-C-N 114.924 -1.035 . . . . 0.0 109.097 170.775 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo . . . . . 0 CA--C 1.534 0.524 0 N-CA-C 114.041 0.746 . . . . 0.0 114.041 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 27.0 mm -108.1 123.5 63.68 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -89.05 -32.52 17.53 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-O 116.819 -1.562 . . . . 0.0 109.878 169.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.9 tp -130.49 144.09 51.18 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 121.1 1.773 . . . . 0.0 112.297 -172.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.3 mp -132.95 109.16 9.38 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.008 1.323 . . . . 0.0 107.707 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -87.74 115.27 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 104.72 -2.326 . . . . 0.0 104.72 168.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.73 153.33 29.77 Favored Glycine 0 CA--C 1.527 0.784 0 N-CA-C 109.321 -1.511 . . . . 0.0 109.321 170.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.35 144.35 30.65 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 103.872 -2.64 . . . . 0.0 103.872 171.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.3 m -142.32 142.47 32.51 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 169.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -145.1 136.3 24.96 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -170.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.85 -24.46 52.67 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.907 0.483 . . . . 0.0 111.889 -175.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -143.53 157.41 44.46 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.896 0.878 . . . . 0.0 110.081 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.31 -35.12 73.22 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.52 -32.4 60.48 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.904 -1.122 . . . . 0.0 111.033 177.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.8 m -62.02 -42.28 99.0 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 169.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 22.2 t60 -57.71 -49.04 77.87 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.134 0.974 . . . . 0.0 110.17 173.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.4 mm -56.41 -54.98 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 118.89 0.768 . . . . 0.0 109.604 179.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.71 -38.85 94.46 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-N 118.549 0.613 . . . . 0.0 111.582 -176.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.37 -49.86 57.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.674 1.189 . . . . 0.0 110.901 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.0 mm -55.83 -42.7 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.588 1.155 . . . . 0.0 109.145 176.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.7 mm-40 -69.54 -14.59 62.93 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 118.381 -0.818 . . . . 0.0 111.936 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.85 -42.34 16.51 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 170.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.4 mt -68.76 -29.3 67.66 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 121.78 -0.575 . . . . 0.0 111.708 -177.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.1 m -56.61 -22.49 34.33 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 170.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -77.24 -18.29 57.76 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.584 1.084 . . . . 0.0 111.519 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 42.9 mt -103.51 -61.26 1.44 Allowed 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.971 0.908 . . . . 0.0 110.103 -177.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.51 -27.65 69.29 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.92 0.888 . . . . 0.0 113.046 -174.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.5 m -106.93 29.32 7.16 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.134 0.574 . . . . 0.0 110.577 -175.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -130.59 104.88 7.47 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 123.909 0.884 . . . . 0.0 108.686 175.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -58.63 -25.55 62.8 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.08 -177.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.53 -48.22 73.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 121.273 0.559 . . . . 0.0 109.564 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.59 -42.2 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 123.885 0.874 . . . . 0.0 109.013 175.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 45.5 mt -60.86 -33.91 73.8 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 118.714 0.688 . . . . 0.0 111.758 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -69.34 -43.46 73.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 120.821 -1.175 . . . . 0.0 109.587 172.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -62.95 -33.29 75.04 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.864 0.756 . . . . 0.0 110.321 -177.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.8 pp -81.16 -42.0 21.53 Favored 'General case' 0 C--N 1.342 0.241 0 C-N-CA 123.451 0.7 . . . . 0.0 111.2 177.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 55.2 mt -64.48 -20.25 66.07 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.551 1.069 . . . . 0.0 111.743 176.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 59.9 p -108.79 16.33 22.86 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.983 1.313 . . . . 0.0 111.167 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.39 102.62 0.71 Allowed 'General case' 0 C--N 1.346 0.42 0 CA-C-N 119.254 0.934 . . . . 0.0 111.18 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.3 m -71.75 -17.0 62.22 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.496 0.718 . . . . 0.0 112.272 175.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.3 p -153.76 162.44 41.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.813 0.733 . . . . 0.0 111.184 -171.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -57.61 -37.24 72.92 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.418 1.087 . . . . 0.0 109.401 169.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -58.39 -44.16 88.81 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-O 118.618 -0.706 . . . . 0.0 110.916 176.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -60.04 -38.13 81.86 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 119.122 0.874 . . . . 0.0 112.121 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 38.3 mt -69.9 -44.77 69.02 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.706 0.685 . . . . 0.0 109.971 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -65.55 -26.58 67.94 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.087 -1.008 . . . . 0.0 112.569 175.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -66.15 -35.81 81.47 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 120.344 -1.472 . . . . 0.0 110.826 174.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.44 -39.34 84.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.729 0.811 . . . . 0.0 109.784 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 33.7 mm -58.21 -51.51 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 173.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.9 m -65.57 -24.53 67.11 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.469 -169.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . 0.407 ' HG3' HH11 ' A' ' 146' ' ' ARG . 2.2 ttm-85 -60.19 -25.29 65.46 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.398 1.479 . . . . 0.0 113.825 173.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.973 -0.904 . . . . 0.0 111.065 -173.666 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 tpt . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.43 112.84 1.91 Allowed 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 169.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.56 -34.01 73.53 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 169.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.9 p -59.53 -5.74 0.91 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.921 1.688 . . . . 0.0 113.413 171.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -109.19 11.54 25.44 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.098 1.359 . . . . 0.0 113.341 174.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -130.96 -46.63 1.02 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.34 1.056 . . . . 0.0 109.6 169.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -75.22 118.26 69.27 Favored Pre-proline 0 CA--C 1.542 0.642 0 N-CA-C 104.302 -2.481 . . . . 0.0 104.302 170.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.9 -78.71 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.646 2.231 . . . . 0.0 111.394 -169.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -168.5 165.39 12.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 128.316 2.646 . . . . 0.0 104.88 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 56.99 15.74 2.49 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.711 1.204 . . . . 0.0 113.719 171.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.5 m -117.53 28.64 8.33 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.95 1.3 . . . . 0.0 110.489 -169.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 mt -122.73 144.54 31.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 171.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 69.9 m -157.07 157.33 34.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.852 0.861 . . . . 0.0 109.488 169.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 99.2 t -122.21 141.06 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 104.248 -2.501 . . . . 0.0 104.248 170.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.5 mt -136.18 144.11 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 125.29 1.436 . . . . 0.0 107.86 -168.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -70.68 -36.04 73.11 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.159 -0.338 . . . . 0.0 111.24 177.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 p -175.11 146.41 0.85 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 126.299 1.84 . . . . 0.0 106.292 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.28 157.67 20.52 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 169.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -62.7 -37.11 85.18 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.009 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -165.2 -179.46 5.64 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 126.754 2.021 . . . . 0.0 107.125 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 69.0 p-90 -61.78 -35.17 77.37 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.882 0.765 . . . . 0.0 111.864 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.453 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 51.3 mt-30 -51.79 -53.94 34.32 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.64 1.176 . . . . 0.0 108.191 170.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -66.57 -34.39 77.78 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 121.684 -0.635 . . . . 0.0 111.185 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.24 -31.56 72.46 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 121.82 -0.55 . . . . 0.0 110.795 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.74 -48.3 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 170.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -56.51 -46.21 80.66 Favored 'General case' 0 C--O 1.223 -0.327 0 O-C-N 122.033 -0.417 . . . . 0.0 110.08 178.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -64.52 -29.32 70.35 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 118.003 -0.998 . . . . 0.0 112.293 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.2 m -66.93 -23.53 65.98 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 120.17 1.35 . . . . 0.0 111.869 172.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.1 mmt -123.79 -17.96 6.19 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 -168.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.8 p -57.17 -34.82 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 120.276 1.398 . . . . 0.0 112.472 -169.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.5 m -64.77 -44.65 89.34 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 118.654 0.661 . . . . 0.0 109.727 178.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 89.3 mt -65.05 -36.67 85.1 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.182 0.593 . . . . 0.0 109.709 177.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 51.1 tp -61.61 -48.25 81.76 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.22 0.608 . . . . 0.0 109.924 177.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -65.42 -37.14 86.04 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 124.157 0.983 . . . . 0.0 112.168 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -76.56 2.11 14.84 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.604 1.162 . . . . 0.0 111.859 175.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.414 0.0 OUTLIER 48.64 30.34 2.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.703 2.401 . . . . 0.0 116.019 -169.956 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -66.68 -23.66 66.16 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.11 -0.994 . . . . 0.0 109.762 168.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.0 pt -140.88 179.28 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 C-N-CA 126.063 1.745 . . . . 0.0 109.905 -177.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 m -121.09 160.53 23.47 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.899 2.08 . . . . 0.0 108.46 175.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.02 -33.23 71.72 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.318 -0.864 . . . . 0.0 112.883 -171.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -59.51 -30.82 68.84 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.864 -0.522 . . . . 0.0 111.885 176.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -61.16 -42.7 99.02 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.312 0.645 . . . . 0.0 110.574 -177.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.4 -50.38 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 174.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -68.78 -25.89 64.93 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.501 -0.762 . . . . 0.0 112.003 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.76 98.22 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 119.473 1.033 . . . . 0.0 110.909 174.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.9 mt -66.96 -44.06 88.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.453 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.6 mttt -60.9 -44.64 96.86 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.352 0.523 . . . . 0.0 109.915 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.69 -37.28 86.75 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.125 0.97 . . . . 0.0 111.47 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.0 m -63.31 -38.02 89.54 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.635 -0.666 . . . . 0.0 110.44 172.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 17.5 m . . . . . 0 CA--C 1.541 0.624 0 C-N-CA 123.434 0.694 . . . . 0.0 110.738 176.615 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.1 mm -135.2 142.42 39.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 126.6 1.96 . . . . 0.0 105.914 -174.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mp -132.16 -28.6 1.7 Allowed 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.38 0.672 . . . . 0.0 112.124 -173.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.13 164.87 20.2 Favored Pre-proline 0 C--O 1.238 0.47 0 C-N-CA 125.11 1.364 . . . . 0.0 107.596 173.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.13 123.45 11.0 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.28 1.987 . . . . 0.0 109.507 169.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.54 3.66 90.43 Favored Glycine 0 CA--C 1.535 1.338 0 CA-C-O 117.892 -1.504 . . . . 0.0 115.204 178.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 58.0 t -128.27 122.76 58.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 120.241 2.021 . . . . 0.0 108.56 -173.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.78 163.05 23.71 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 124.948 1.299 . . . . 0.0 110.262 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.2 ttm -132.8 60.46 50.11 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 123.414 0.686 . . . . 0.0 111.64 175.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -50.59 143.62 27.79 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.304 2.003 . . . . 0.0 114.432 -171.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -179.72 154.9 0.62 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 128.205 2.602 . . . . 0.0 106.672 -169.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.07 161.66 36.17 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 125.515 1.526 . . . . 0.0 107.631 169.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.6 ptt85 -49.93 139.56 17.08 Favored Pre-proline 0 CA--C 1.54 0.568 0 CA-C-O 118.079 -0.962 . . . . 0.0 109.729 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -46.89 -43.26 24.38 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 123.692 2.928 . . . . 0.0 113.008 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.08 -9.65 11.33 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.484 1.514 . . . . 0.0 114.368 -177.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 64.0 m -76.47 -3.91 39.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.011 0.823 . . . . 0.0 112.388 172.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 132.66 13.29 1.65 Allowed Glycine 0 C--N 1.334 0.456 0 CA-C-O 118.305 -1.275 . . . . 0.0 113.373 171.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.4 145.17 56.16 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.296 1.548 . . . . 0.0 109.231 169.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.0 mt -126.2 -33.92 2.58 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 124.444 1.098 . . . . 0.0 110.261 -175.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -139.52 168.59 19.48 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.103 1.761 . . . . 0.0 107.873 176.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 96.9 m -98.8 118.53 35.75 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 123.351 0.66 . . . . 0.0 109.247 177.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -165.63 177.82 40.7 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 123.804 0.716 . . . . 0.0 112.382 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 59.0 mtt -142.22 166.97 23.24 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.737 1.269 . . . . 0.0 112.841 -171.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.2 p -145.58 158.55 43.83 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.264 1.826 . . . . 0.0 108.762 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 mp -134.44 133.16 40.18 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.988 1.315 . . . . 0.0 107.542 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 26.6 m -139.05 134.9 33.6 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -174.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.1 tp -123.56 142.18 51.28 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 169.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.9 mp -121.34 115.98 23.95 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 126.973 2.109 . . . . 0.0 105.584 177.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -62.99 -25.03 68.19 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.115 0.966 . . . . 0.0 112.486 -174.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -110.52 -7.98 14.68 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.8 1.24 . . . . 0.0 111.765 177.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 59.39 -176.37 2.94 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 123.842 0.734 . . . . 0.0 112.065 -169.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -151.49 157.92 5.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 169.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -98.26 109.77 22.47 Favored 'General case' 0 C--N 1.333 -0.133 0 O-C-N 121.182 -0.949 . . . . 0.0 112.139 -169.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 N--CA 1.449 -0.523 0 N-CA-C 106.241 -1.762 . . . . 0.0 106.241 169.123 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 N--CA 1.46 -0.485 0 N-CA-C 111.612 -0.188 . . . . 0.0 111.612 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 28.4 mm -69.11 119.25 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.1 mtpt -97.14 -17.35 19.97 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.851 -1.071 . . . . 0.0 110.78 174.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 59.5 tp -142.09 128.44 19.98 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 119.951 1.251 . . . . 0.0 110.412 -169.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.1 mp -137.82 113.56 9.71 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -170.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.2 mp -100.16 111.56 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 175.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.7 147.79 31.33 Favored Glycine 0 CA--C 1.529 0.954 0 N-CA-C 110.065 -1.214 . . . . 0.0 110.065 173.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.34 141.05 37.66 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 171.09 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 28.5 p -131.33 142.34 50.07 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 127.58 2.352 . . . . 0.0 106.533 171.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -145.86 133.6 21.12 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.61 -22.17 57.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 122.818 0.447 . . . . 0.0 111.42 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -145.83 154.49 42.05 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.141 0.977 . . . . 0.0 109.77 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.04 -31.69 69.07 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -177.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -77.61 -32.85 53.77 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.24 0.927 . . . . 0.0 111.373 178.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 4.4 m -60.95 -42.88 99.1 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 169.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -48.83 77.01 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.539 1.136 . . . . 0.0 110.51 171.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 6.0 mm -58.24 -45.56 88.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 123.37 0.668 . . . . 0.0 110.57 -177.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -73.96 -33.64 57.09 Favored Glycine 0 CA--C 1.529 0.917 0 CA-C-N 119.715 1.143 . . . . 0.0 111.597 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.66 -46.96 80.23 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.122 0.969 . . . . 0.0 110.886 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -54.39 -45.04 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 125.076 1.35 . . . . 0.0 108.444 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -69.19 -9.96 55.43 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 118.297 -0.858 . . . . 0.0 112.807 -178.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -90.36 -38.43 13.34 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 119.796 1.18 . . . . 0.0 109.056 170.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.76 -31.82 65.2 Favored 'General case' 0 CA--C 1.517 -0.321 0 O-C-N 121.759 -0.588 . . . . 0.0 111.055 -178.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.2 m -61.09 -20.91 63.17 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.495 0.718 . . . . 0.0 112.108 173.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -66.95 -25.19 66.22 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.656 1.116 . . . . 0.0 110.212 174.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 41.5 mt -103.04 -61.38 1.41 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.132 0.973 . . . . 0.0 111.046 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.98 -1.22 18.94 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -172.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 37.1 m -114.91 26.47 10.13 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.6 1.091 . . . . 0.0 111.653 173.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -138.58 96.73 3.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 -172.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -58.23 -23.91 57.47 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.677 0.791 . . . . 0.0 112.501 -173.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -62.73 -49.59 74.43 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 121.323 0.582 . . . . 0.0 109.624 174.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.82 -40.37 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 C-N-CA 124.646 1.178 . . . . 0.0 109.51 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 31.9 mt -54.79 -43.49 72.91 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 118.574 -0.727 . . . . 0.0 111.18 -172.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -67.17 -38.15 84.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 118.693 0.679 . . . . 0.0 110.708 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -70.17 -32.64 70.69 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.038 0.535 . . . . 0.0 110.098 -176.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 30.2 mt -72.78 -52.5 14.75 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 169.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.2 mt -58.59 -11.62 3.22 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.512 1.125 . . . . 0.0 113.746 -175.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 62.5 p -116.12 15.67 16.02 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.101 1.361 . . . . 0.0 110.797 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.44 95.41 0.02 OUTLIER 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.02 1.328 . . . . 0.0 110.73 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 50.7 m -82.39 -14.59 54.97 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.686 0.794 . . . . 0.0 111.099 -176.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.2 m -146.76 154.98 42.03 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 125.929 1.692 . . . . 0.0 106.728 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -54.88 -35.1 63.73 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.042 1.337 . . . . 0.0 111.687 178.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -53.22 -36.23 60.8 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.18 0.592 . . . . 0.0 111.988 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -64.79 -35.85 82.41 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 123.999 0.919 . . . . 0.0 112.426 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 59.3 mt -67.83 -44.12 77.95 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -75.08 -24.13 58.13 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -176.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -60.22 -44.45 95.16 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 120.736 -1.228 . . . . 0.0 109.658 171.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.87 -35.53 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 C-N-CA 124.581 1.153 . . . . 0.0 109.792 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.9 -49.78 72.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 122.958 0.503 . . . . 0.0 110.315 169.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 39.3 m -64.79 -27.19 68.72 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -168.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 18.3 mtt180 -69.56 -25.85 64.2 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.201 0.6 . . . . 0.0 111.596 175.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.865 0 C-N-CA 125.815 1.674 . . . . 0.0 111.449 -169.583 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 tpt . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 110.202 -0.295 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -66.1 109.28 2.54 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 168.782 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -54.02 -45.19 71.49 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.35 -19.22 5.08 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.913 1.685 . . . . 0.0 113.712 -178.032 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -66.64 -30.7 71.03 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-N 119.494 1.043 . . . . 0.0 111.967 176.621 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -86.56 -34.46 19.92 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.902 -0.571 . . . . 0.0 112.042 -174.137 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -90.08 104.47 8.7 Favored Pre-proline 0 N--CA 1.471 0.608 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 -173.491 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.05 -66.11 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 122.935 2.423 . . . . 0.0 113.863 -169.368 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.426 ' C ' ' H ' ' A' ' 11' ' ' SER . 34.9 tt0 -167.49 -64.73 0.03 OUTLIER 'General case' 0 C--O 1.231 0.127 0 C-N-CA 125.49 1.516 . . . . 0.0 109.792 178.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -69.18 5.76 1.15 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.156 1.382 . . . . 0.0 112.26 177.159 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' SER . . . . . 0.426 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -63.44 -29.84 71.06 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 126.116 1.767 . . . . 0.0 111.216 -174.019 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.1 mm -91.23 134.96 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.323 0 C-N-CA 125.734 1.613 . . . . 0.0 107.109 -169.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.4 m -157.27 151.52 24.94 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.238 0.926 . . . . 0.0 111.223 170.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 76.5 t -122.62 143.55 35.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 169.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.8 mt -140.89 147.8 22.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -170.023 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -73.55 -47.14 43.04 Favored 'General case' 0 CA--C 1.531 0.218 0 O-C-N 121.701 -0.624 . . . . 0.0 109.935 172.055 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.9 p -161.85 146.28 12.76 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -177.661 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.93 158.81 29.2 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 169.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.97 -43.63 86.58 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.525 0.73 . . . . 0.0 109.956 174.787 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -167.78 178.03 5.46 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 128.377 2.671 . . . . 0.0 107.452 175.067 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -57.5 -35.6 70.44 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 126.021 1.729 . . . . 0.0 113.734 176.767 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.4 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.4 mt-30 -62.32 -51.18 68.68 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 120.52 1.509 . . . . 0.0 108.308 171.772 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -59.83 -34.26 72.86 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 121.76 -0.587 . . . . 0.0 111.501 179.176 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.87 -32.67 74.49 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.584 -0.698 . . . . 0.0 110.919 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.59 -45.82 81.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 172.113 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -56.72 -42.8 79.83 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 121.624 -0.673 . . . . 0.0 110.569 176.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -70.31 -16.37 63.0 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.222 -0.924 . . . . 0.0 112.996 174.209 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m -79.49 -19.11 50.51 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 120.088 1.313 . . . . 0.0 110.916 169.25 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 7.9 mmt -126.36 -17.42 5.16 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 -168.615 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -59.67 -36.15 63.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 120.908 1.685 . . . . 0.0 112.03 -169.37 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.0 m -61.83 -26.81 68.35 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.839 0.745 . . . . 0.0 112.074 179.42 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.8 mt -86.25 -43.83 12.63 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.96 1.304 . . . . 0.0 108.62 177.012 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.7 tp -55.89 -41.93 75.19 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.79 0.836 . . . . 0.0 110.779 177.638 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -60.16 -30.2 69.17 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 126.199 1.8 . . . . 0.0 113.556 -174.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.9 mttm -111.54 20.05 17.55 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -177.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.341 0.7 OUTLIER 47.47 35.99 4.69 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.403 1.881 . . . . 0.0 114.911 -176.022 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -64.51 -22.18 66.89 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.258 -0.901 . . . . 0.0 110.112 168.574 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.7 pt -146.12 165.7 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 127.303 2.241 . . . . 0.0 107.569 -177.122 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.4 p -98.5 166.86 11.16 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.3 1.04 . . . . 0.0 108.864 169.292 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -60.72 -31.38 70.67 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.283 -0.886 . . . . 0.0 111.726 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -59.46 -32.86 70.62 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 122.935 0.494 . . . . 0.0 111.626 176.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -59.37 -45.97 89.95 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.964 0.505 . . . . 0.0 110.329 -179.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.01 -49.79 82.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 176.559 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -68.53 -27.24 65.92 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 118.27 -0.872 . . . . 0.0 112.082 -173.636 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.71 -45.0 90.53 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 119.417 1.008 . . . . 0.0 110.557 172.697 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 25.4 mt -68.52 -46.72 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 -178.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.4 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.7 mttt -59.73 -47.69 84.64 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -177.432 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.13 -44.08 97.43 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 123.85 0.86 . . . . 0.0 110.846 -177.176 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 m -59.74 -48.71 80.59 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.463 0.705 . . . . 0.0 109.942 175.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 69.4 m . . . . . 0 CA--C 1.536 0.404 0 C-N-CA 124.141 0.976 . . . . 0.0 111.27 178.912 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.8 mm -120.97 135.24 61.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 175.552 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.73 -31.44 4.25 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 122.965 0.506 . . . . 0.0 111.854 -169.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.82 164.01 18.46 Favored Pre-proline 0 C--O 1.236 0.368 0 C-N-CA 125.261 1.424 . . . . 0.0 107.532 -177.64 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -45.9 115.2 0.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.306 2.671 . . . . 0.0 111.853 171.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.55 1.07 87.88 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-O 117.719 -1.601 . . . . 0.0 114.693 176.199 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 69.9 t -124.93 122.13 62.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 119.966 1.883 . . . . 0.0 108.572 -169.925 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.12 169.76 11.38 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.372 1.469 . . . . 0.0 109.643 176.373 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 ttm -139.95 59.92 14.26 Favored Pre-proline 0 CA--C 1.537 0.445 0 C-N-CA 123.761 0.824 . . . . 0.0 110.698 174.458 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -57.24 123.85 14.79 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 121.232 1.288 . . . . 0.0 109.83 -174.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -167.08 172.46 10.05 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.129 2.572 . . . . 0.0 108.454 174.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -132.94 171.09 14.42 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.079 1.352 . . . . 0.0 110.24 -174.27 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -57.03 155.36 16.17 Favored Pre-proline 0 N--CA 1.472 0.632 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.602 173.082 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -61.26 -35.67 83.63 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 121.57 1.513 . . . . 0.0 109.361 -176.784 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -67.65 -12.72 61.09 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.971 1.309 . . . . 0.0 112.437 -176.338 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 71.0 m -79.96 -3.3 47.68 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.755 0.707 . . . . 0.0 111.669 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 130.55 19.99 1.28 Allowed Glycine 0 C--N 1.337 0.626 0 CA-C-O 118.33 -1.261 . . . . 0.0 113.343 175.324 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.09 146.12 52.85 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 119.792 1.796 . . . . 0.0 109.041 169.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.1 mt -133.71 -28.93 1.37 Allowed 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.776 1.23 . . . . 0.0 111.045 -173.659 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -139.91 174.0 10.95 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.226 1.81 . . . . 0.0 107.749 172.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 95.1 m -105.92 126.44 52.18 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.353 1.061 . . . . 0.0 110.613 176.128 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.99 -176.14 41.33 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 125.865 1.698 . . . . 0.0 111.661 -177.597 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 42.1 mtt -146.66 171.3 15.32 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.762 1.625 . . . . 0.0 111.902 -176.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.6 m -136.4 161.72 35.05 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.56 1.944 . . . . 0.0 108.469 174.546 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 30.5 tp -142.52 103.18 4.2 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.21 1.404 . . . . 0.0 108.137 178.508 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 89.7 m -121.76 138.53 54.33 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.97 0.908 . . . . 0.0 108.732 -171.577 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.1 tt -134.33 133.28 40.51 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 124.214 1.005 . . . . 0.0 108.412 179.095 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.7 mp -113.51 122.14 46.37 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 126.16 1.784 . . . . 0.0 107.122 179.554 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -60.56 -40.97 93.58 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 118.931 0.787 . . . . 0.0 111.738 -178.727 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -87.54 -20.95 25.75 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 124.371 1.068 . . . . 0.0 111.414 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.5 -177.61 21.0 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 110.591 -1.003 . . . . 0.0 110.591 -168.708 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -148.56 167.54 3.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 169.241 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -120.03 95.99 4.98 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 121.756 -0.59 . . . . 0.0 110.205 -169.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 . . . . . 0 CA--C 1.539 0.527 0 C-N-CA 123.163 0.585 . . . . 0.0 110.392 170.834 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 N--CA 1.459 -0.557 0 CA-C-O 121.381 0.492 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 36.3 mm -112.99 139.27 39.02 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.357 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -178.266 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -116.94 -7.73 11.36 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 117.835 -1.079 . . . . 0.0 110.743 175.644 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 15.4 tp -145.1 134.08 22.55 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 120.161 1.346 . . . . 0.0 110.712 -176.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mp -138.52 111.6 7.9 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 -169.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.8 mp -92.84 114.79 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 172.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.16 154.02 47.37 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 170.002 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -143.77 150.4 38.51 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 169.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.0 p -144.5 142.29 30.14 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 168.815 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.59 132.75 15.35 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 119.395 0.998 . . . . 0.0 108.505 -179.653 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.28 -19.85 57.9 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.818 -174.176 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -140.48 154.59 46.65 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.888 0.875 . . . . 0.0 110.352 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.82 -37.46 76.45 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -178.161 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -71.85 -30.22 65.22 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.966 -1.083 . . . . 0.0 110.83 176.43 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.3 m -65.87 -36.42 83.38 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.437 169.835 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -59.82 -48.87 79.94 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 119.858 1.208 . . . . 0.0 109.476 170.857 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.3 mm -55.34 -54.65 22.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-N 118.703 0.683 . . . . 0.0 109.35 179.518 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.29 -39.25 96.95 Favored Glycine 0 CA--C 1.53 0.997 0 CA-C-N 118.888 0.767 . . . . 0.0 111.692 -176.183 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.67 -54.97 20.28 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.912 0.885 . . . . 0.0 110.373 179.007 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.6 mm -51.6 -48.24 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 C-N-CA 125.901 1.68 . . . . 0.0 108.424 177.037 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -66.79 -18.01 65.16 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.503 -0.748 . . . . 0.0 111.876 -176.524 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.86 -48.4 8.79 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 123.691 0.796 . . . . 0.0 109.369 173.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.2 pp -67.57 -23.56 65.42 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 118.24 0.473 . . . . 0.0 112.131 -178.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 60.2 m -62.95 -22.91 67.13 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.863 0.865 . . . . 0.0 111.726 174.056 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -66.17 -17.46 64.74 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.945 0.793 . . . . 0.0 110.035 173.505 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 34.8 mt -108.62 -60.94 1.67 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.009 1.324 . . . . 0.0 110.119 179.456 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.9 mt -62.77 -21.03 65.55 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.877 1.436 . . . . 0.0 114.877 -175.604 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 38.1 m -111.13 26.15 11.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.945 0.793 . . . . 0.0 110.826 -179.201 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -132.51 97.38 4.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.064 1.346 . . . . 0.0 107.74 178.409 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.06 -27.8 54.92 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.691 0.797 . . . . 0.0 112.456 -177.128 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -65.12 -44.55 88.34 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 123.163 0.585 . . . . 0.0 110.02 176.584 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.92 -43.31 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 174.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.8 mt -55.66 -43.5 76.35 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 118.58 0.627 . . . . 0.0 111.128 -174.532 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -67.37 -38.85 85.41 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.775 0.43 . . . . 0.0 110.614 178.797 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -70.03 -33.23 71.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 118.663 0.665 . . . . 0.0 109.91 -176.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.4 mt -68.3 -56.31 9.05 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 169.834 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 40.3 mt -57.64 -12.12 2.63 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 -174.395 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 50.9 p -114.11 7.45 16.69 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.067 1.347 . . . . 0.0 111.433 179.358 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.48 110.86 1.2 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.499 1.519 . . . . 0.0 110.235 175.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.6 m -68.25 -28.02 66.85 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.099 0.559 . . . . 0.0 111.838 176.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.2 m -149.54 160.53 43.4 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.056 1.343 . . . . 0.0 108.917 -172.183 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 57.2 mp0 -54.24 -34.47 60.79 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.119 1.367 . . . . 0.0 111.408 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -53.22 -38.27 62.77 Favored 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 123.119 0.568 . . . . 0.0 112.442 -179.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -80.75 -27.7 36.72 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 119.024 0.829 . . . . 0.0 110.605 -178.234 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.9 mt -65.48 -50.5 65.11 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.434 1.015 . . . . 0.0 108.303 171.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.72 -33.94 73.66 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.123 0.969 . . . . 0.0 112.679 176.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -59.83 -43.45 94.56 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 118.955 0.798 . . . . 0.0 110.677 175.185 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 77.4 mt -70.5 -35.12 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 123.166 0.586 . . . . 0.0 109.716 -178.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.3 mm -57.17 -52.37 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 169.469 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 21.4 m -65.1 -27.83 69.03 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.279 -170.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -59.3 -24.55 63.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.275 1.83 . . . . 0.0 113.601 174.565 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.931 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 -176.966 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.484 1.249 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -58.71 121.09 10.2 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 169.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.79 -45.42 78.48 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.7 m -52.91 -28.03 21.45 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.29 1.436 . . . . 0.0 113.701 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -58.15 -27.53 63.88 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.771 0.829 . . . . 0.0 112.343 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -92.68 -7.26 47.3 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.886 0.875 . . . . 0.0 112.851 -177.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -108.7 106.01 57.99 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 119.967 1.258 . . . . 0.0 108.568 -171.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.87 -62.22 0.12 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.598 2.199 . . . . 0.0 113.299 -173.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -174.33 -65.93 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.67 1.188 . . . . 0.0 109.182 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.1 m -73.26 2.97 6.37 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.229 1.411 . . . . 0.0 112.604 -176.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.19 -4.01 15.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 128.436 2.694 . . . . 0.0 114.289 -169.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 21.0 mt -126.55 127.12 70.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 120.332 1.423 . . . . 0.0 108.188 -168.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.9 m -143.36 145.92 33.09 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.292 1.037 . . . . 0.0 111.308 -171.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.9 t -123.85 135.69 62.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 165.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 55.9 mt -138.7 143.06 33.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 -168.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 44.4 t60 -68.18 -49.25 62.11 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.812 -0.555 . . . . 0.0 110.037 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -160.07 145.11 14.98 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.628 1.571 . . . . 0.0 107.088 171.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.5 150.37 47.24 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 167.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -60.49 -40.64 92.05 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.578 0.351 . . . . 0.0 110.832 178.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -161.46 178.25 9.31 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.248 1.419 . . . . 0.0 108.886 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -32.94 63.51 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.915 0.886 . . . . 0.0 113.057 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -76.83 -42.67 39.41 Favored 'General case' 0 C--N 1.339 0.13 0 CA-C-N 119.842 1.201 . . . . 0.0 109.499 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -64.81 -29.06 70.0 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.976 0.353 . . . . 0.0 110.602 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.73 98.25 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.373 -0.83 . . . . 0.0 111.313 173.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.7 mt -67.0 -43.52 89.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -59.14 -47.21 86.13 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.403 0.547 . . . . 0.0 111.081 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -66.19 -20.89 66.27 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.069 0.85 . . . . 0.0 112.844 176.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.9 m -79.47 -8.24 58.99 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.223 0.919 . . . . 0.0 112.181 172.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.2 mmt -131.31 -24.74 2.27 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.9 0.88 . . . . 0.0 112.731 -166.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -58.99 -36.91 64.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 119.216 0.917 . . . . 0.0 111.383 -171.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -66.54 -24.48 66.38 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.61 -0.682 . . . . 0.0 112.819 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.2 mt -85.22 -41.23 15.8 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.871 0.869 . . . . 0.0 109.118 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.0 tp -58.81 -40.29 83.68 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.096 0.958 . . . . 0.0 110.61 175.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -62.5 -26.19 68.41 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.731 1.213 . . . . 0.0 112.935 -176.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -108.08 14.73 24.89 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.367 0.667 . . . . 0.0 110.738 176.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.254 10.8 p30 45.24 41.97 6.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.361 1.865 . . . . 0.0 113.698 -172.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -64.06 -22.29 66.87 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.973 -1.079 . . . . 0.0 110.766 159.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.6 pt -143.45 163.5 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 126.301 1.84 . . . . 0.0 109.011 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.1 m -97.56 163.73 12.73 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.979 1.712 . . . . 0.0 109.274 166.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -57.51 -35.47 70.3 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.598 0.759 . . . . 0.0 112.318 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -58.9 -30.65 67.96 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.143 0.577 . . . . 0.0 112.206 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.74 -45.06 93.36 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.166 0.587 . . . . 0.0 110.244 -179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.5 mp -64.1 -47.31 90.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -64.73 -31.02 72.06 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.62 -0.705 . . . . 0.0 111.567 -174.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.55 -42.24 96.18 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.211 0.914 . . . . 0.0 111.16 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 19.1 mt -67.11 -46.27 84.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.45 -49.31 77.77 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.248 0.476 . . . . 0.0 110.079 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.93 -41.65 99.55 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 123.234 0.614 . . . . 0.0 111.011 -177.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 28.0 m -64.68 -40.93 96.25 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.692 0.397 . . . . 0.0 111.228 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 89.5 m -61.67 -44.52 96.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.866 0.866 . . . . 0.0 109.784 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 76.6 mt -65.33 -42.13 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.27 0.628 . . . . 0.0 109.647 177.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -69.94 -34.05 72.93 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -174.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -140.62 -57.39 0.52 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.424 0.556 . . . . 0.0 111.123 -169.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 153.42 172.84 22.01 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 109.269 -1.533 . . . . 0.0 109.269 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -64.0 128.95 23.07 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.258 1.972 . . . . 0.0 109.817 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -64.95 -48.35 74.36 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 122.385 0.274 . . . . 0.0 110.897 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -112.48 88.63 2.87 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -160.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.5 mm -112.62 131.1 65.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 104.945 -2.242 . . . . 0.0 104.945 169.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -116.71 -27.17 6.74 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 122.784 0.434 . . . . 0.0 111.464 -168.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.05 161.39 29.58 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 125.53 1.532 . . . . 0.0 107.158 174.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -47.91 115.63 1.57 Allowed 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.11 2.54 . . . . 0.0 111.085 170.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.52 3.66 71.43 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 117.928 -1.484 . . . . 0.0 114.508 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.1 t -129.95 127.25 63.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 119.781 1.79 . . . . 0.0 109.563 -169.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.29 168.8 17.91 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.069 1.347 . . . . 0.0 110.915 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.2 ttm -140.99 73.26 27.18 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 123.622 0.769 . . . . 0.0 110.947 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -50.38 122.68 9.85 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.991 2.46 . . . . 0.0 112.774 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -163.39 155.06 17.28 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.176 1.791 . . . . 0.0 107.471 -175.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.61 165.86 25.82 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.329 1.452 . . . . 0.0 108.077 171.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -60.63 153.25 63.23 Favored Pre-proline 0 N--CA 1.469 0.523 0 O-C-N 121.272 -0.892 . . . . 0.0 109.876 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -46.9 -46.75 17.86 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.218 2.612 . . . . 0.0 113.048 176.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -66.99 -11.05 55.79 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.601 1.16 . . . . 0.0 113.867 -177.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 80.8 m -74.39 -11.59 60.29 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.646 1.112 . . . . 0.0 112.355 172.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 136.42 24.23 0.5 Allowed Glycine 0 CA--C 1.526 0.735 0 CA-C-O 118.71 -1.05 . . . . 0.0 113.86 171.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.32 155.39 38.24 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 119.547 1.674 . . . . 0.0 109.069 168.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.8 mt -132.86 -25.78 1.82 Allowed 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.796 1.239 . . . . 0.0 111.063 -174.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -145.88 -168.72 3.06 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.652 1.981 . . . . 0.0 106.85 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 41.0 m -125.45 126.79 45.48 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.363 0.665 . . . . 0.0 109.582 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.37 -176.23 40.98 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.046 0.831 . . . . 0.0 111.73 -176.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 62.1 mtt -143.71 168.47 19.82 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.562 1.545 . . . . 0.0 111.401 -176.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.3 m -138.21 168.7 19.18 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.385 1.874 . . . . 0.0 108.478 171.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.4 tp -151.45 120.84 6.84 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.95 1.7 . . . . 0.0 107.425 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 42.4 m -136.17 129.02 31.07 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.8 tp -117.56 136.67 53.11 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 175.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.3 mp -115.48 116.15 27.72 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -59.41 -39.88 84.87 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.637 0.653 . . . . 0.0 111.621 -175.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -102.36 -2.31 29.16 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.38 0.672 . . . . 0.0 112.309 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 65.85 -175.05 18.5 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.198 0.904 . . . . 0.0 113.674 -176.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -150.59 149.03 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 167.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -86.67 119.27 26.73 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -85.91 144.31 39.06 Favored Pre-proline 0 CA--C 1.535 0.395 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 172.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -66.07 137.0 46.69 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.035 1.823 . . . . 0.0 109.936 -174.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 74.8 -7.51 20.16 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-O 118.232 -1.316 . . . . 0.0 114.219 177.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -76.3 162.36 27.98 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.933 1.867 . . . . 0.0 109.884 172.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -77.71 -26.5 50.13 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -175.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -156.47 169.25 10.84 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 124.552 1.141 . . . . 0.0 109.823 -175.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -71.27 146.8 51.94 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 CA-C-N 121.108 1.431 . . . . 0.0 111.783 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 48.4 mm -88.39 135.73 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 177.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -109.86 -25.04 10.53 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.742 0.817 . . . . 0.0 111.487 172.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 55.4 tp -127.98 126.51 41.51 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -169.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mp -133.28 139.27 46.82 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 -178.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 4.7 mt -125.49 123.62 65.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 173.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.99 155.48 36.75 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 176.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -149.99 138.73 20.85 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 176.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 54.3 p -139.11 155.45 47.88 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.107 1.363 . . . . 0.0 108.815 164.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.57 140.79 22.22 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.485 0.714 . . . . 0.0 109.634 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.23 -16.99 59.71 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -154.4 154.81 33.89 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.645 1.178 . . . . 0.0 109.221 -173.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.46 -35.36 73.92 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.62 0.768 . . . . 0.0 112.79 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.52 -38.55 74.28 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 119.474 1.034 . . . . 0.0 110.429 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.1 m -63.55 -38.23 90.36 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.172 0.589 . . . . 0.0 110.31 173.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -59.45 -49.23 78.62 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.096 172.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.4 mm -58.97 -46.08 91.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 119.557 1.072 . . . . 0.0 109.876 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.06 -46.64 93.45 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-N 118.846 0.748 . . . . 0.0 111.342 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.08 -46.36 89.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.419 0.688 . . . . 0.0 111.232 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.3 mm -56.62 -51.95 59.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -59.14 -33.87 71.39 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 118.782 -0.628 . . . . 0.0 111.419 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -64.92 -56.31 14.08 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.764 0.711 . . . . 0.0 110.489 173.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . 0.275 1.4 pp -71.3 -17.41 62.46 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 -174.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.5 m -60.07 -27.28 66.84 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 120.155 1.343 . . . . 0.0 111.607 170.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.08 -12.29 49.08 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.026 0.83 . . . . 0.0 111.801 175.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 69.6 mt -111.78 -51.52 2.85 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.397 1.079 . . . . 0.0 109.428 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 13.6 mt -73.45 -19.95 60.83 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -170.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.4 m -108.95 21.02 17.76 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.92 0.888 . . . . 0.0 110.758 -177.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -128.04 100.04 5.72 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.44 -28.62 63.49 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.687 0.795 . . . . 0.0 112.599 -175.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.31 -39.17 93.37 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.137 0.575 . . . . 0.0 110.386 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.71 -40.29 47.07 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.1 mt -57.7 -43.94 85.54 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.997 0.817 . . . . 0.0 110.615 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -57.83 -51.45 69.54 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.457 0.571 . . . . 0.0 110.05 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -65.05 -33.35 75.83 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.732 0.413 . . . . 0.0 112.087 -175.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 63.3 mt -68.06 -47.37 68.51 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 173.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.0 mt -64.22 -34.87 79.08 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 118.891 -0.576 . . . . 0.0 111.743 -176.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 63.8 p -87.49 -0.66 57.15 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.088 0.858 . . . . 0.0 112.343 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.42 118.19 5.3 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.368 0.985 . . . . 0.0 111.23 -171.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.6 m -73.05 -20.17 61.03 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.174 0.59 . . . . 0.0 112.272 -177.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.5 p -155.68 164.65 38.32 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.592 0.71 . . . . 0.0 110.832 -170.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.09 -30.94 66.64 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.786 0.834 . . . . 0.0 110.528 170.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.0 tptt -64.61 -44.01 91.94 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.47 0.577 . . . . 0.0 110.53 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -67.55 -37.95 83.43 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.258 0.481 . . . . 0.0 110.225 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 56.0 mt -60.59 -45.85 92.43 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.331 0.514 . . . . 0.0 110.357 173.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.81 92.63 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.562 0.745 . . . . 0.0 111.637 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -56.52 -42.45 78.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.759 0.709 . . . . 0.0 110.995 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 70.9 mt -66.78 -35.02 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 122.98 0.512 . . . . 0.0 109.782 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 26.4 mm -64.68 -49.55 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 119.143 0.883 . . . . 0.0 109.316 172.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 38.4 m -59.03 -30.54 68.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.102 0.865 . . . . 0.0 112.392 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -65.93 -22.1 66.47 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.272 1.029 . . . . 0.0 112.415 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.945 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 -178.845 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 tpt . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.738 0.304 . . . . 0.0 110.946 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -68.99 109.48 3.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 169.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.18 -44.29 83.43 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.351 1.06 . . . . 0.0 109.81 -172.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.07 -23.43 20.22 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.723 1.209 . . . . 0.0 112.682 -175.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -58.94 -28.41 66.23 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.776 0.716 . . . . 0.0 111.981 176.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -92.48 -13.29 30.13 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 117.911 -1.043 . . . . 0.0 112.66 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -112.67 85.33 7.36 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 120.974 1.715 . . . . 0.0 107.215 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.58 -59.52 1.16 Allowed 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 123.724 2.949 . . . . 0.0 115.464 -169.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.526 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.8 tp10 -161.62 -77.02 0.05 Allowed 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 118.677 0.672 . . . . 0.0 112.271 -178.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -68.61 13.62 0.09 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.109 1.764 . . . . 0.0 111.843 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.526 ' H ' ' C ' ' A' ' 9' ' ' GLU . 5.5 m -75.65 8.7 2.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 128.508 2.723 . . . . 0.0 113.452 -168.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.4 mm -135.82 134.73 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 104.491 -2.411 . . . . 0.0 104.491 -169.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 75.7 m -155.33 147.31 23.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 118.83 0.741 . . . . 0.0 110.454 174.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 77.4 t -124.06 136.19 61.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 103.866 -2.642 . . . . 0.0 103.866 169.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.426 HG21 ' H ' ' A' ' 17' ' ' SER . 37.6 mt -139.0 147.86 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 N-CA-C 105.159 -2.163 . . . . 0.0 105.159 -169.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -66.87 -42.69 85.19 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.389 -0.819 . . . . 0.0 110.714 175.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.426 ' H ' HG21 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -167.4 145.7 4.81 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.923 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.41 155.19 36.63 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -60.26 -40.12 89.21 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 176.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -167.84 -177.06 3.29 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 128.019 2.528 . . . . 0.0 107.521 172.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -61.76 -33.78 74.69 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 177.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.447 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.7 mt-30 -59.75 -51.48 69.58 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.621 1.555 . . . . 0.0 107.433 172.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -60.57 -34.55 74.35 Favored 'General case' 0 C--O 1.223 -0.337 0 O-C-N 121.646 -0.659 . . . . 0.0 111.521 177.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.5 73.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.629 -0.67 . . . . 0.0 110.883 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.94 -47.47 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 171.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.68 -45.45 81.74 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.743 -0.598 . . . . 0.0 110.557 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -68.57 -17.46 64.14 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 118.048 -0.977 . . . . 0.0 112.64 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.9 m -80.25 -17.61 51.74 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 120.866 1.666 . . . . 0.0 111.87 169.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.8 mmt -125.0 -18.44 5.49 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -169.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.4 -36.23 62.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-N 120.437 1.471 . . . . 0.0 111.734 -169.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.8 m -63.15 -22.34 66.8 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.757 0.708 . . . . 0.0 112.269 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 80.7 mt -89.91 -41.68 11.65 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.24 1.016 . . . . 0.0 109.125 174.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -55.36 -42.15 73.52 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.61 0.764 . . . . 0.0 110.576 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.75 -24.26 66.19 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 125.816 1.646 . . . . 0.0 114.102 -171.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -111.01 21.96 15.84 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.029 0.377 . . . . 0.0 110.422 172.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 54.84 34.19 21.46 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.996 1.318 . . . . 0.0 113.166 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -68.37 -22.12 64.68 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 120.583 -1.323 . . . . 0.0 109.71 168.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.1 pt -142.2 174.69 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 126.74 2.016 . . . . 0.0 108.557 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 m -112.24 159.9 18.15 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 126.471 1.908 . . . . 0.0 107.813 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.2 -31.22 69.95 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.24 -0.913 . . . . 0.0 112.337 -174.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -58.09 -32.48 68.11 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.052 0.541 . . . . 0.0 112.004 175.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -61.13 -44.13 97.81 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.358 0.663 . . . . 0.0 110.48 -177.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.2 mp -59.17 -50.13 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 174.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 36.9 tp60 -69.37 -25.01 63.96 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.437 -0.792 . . . . 0.0 112.142 -175.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.56 98.99 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 119.699 1.136 . . . . 0.0 110.627 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.0 mt -68.4 -45.53 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.447 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.3 mttt -60.73 -41.08 94.61 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.382 0.537 . . . . 0.0 110.096 -178.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -65.15 -38.76 91.62 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.892 0.877 . . . . 0.0 111.41 177.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -63.05 -36.7 84.44 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.652 -0.655 . . . . 0.0 110.376 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.6 m -67.47 -36.98 82.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.04 0.936 . . . . 0.0 110.664 176.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 86.9 mt -64.65 -42.34 94.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 119.171 0.896 . . . . 0.0 109.578 172.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -64.52 -34.4 78.15 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.468 0.707 . . . . 0.0 112.329 -172.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -150.25 -51.05 0.14 Allowed 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 123.229 0.612 . . . . 0.0 111.253 -169.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.28 -179.46 22.36 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 109.028 -1.629 . . . . 0.0 109.028 -173.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -42.0 117.8 0.82 Allowed 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.845 3.03 . . . . 0.0 112.634 171.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -77.99 -14.0 59.68 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.626 176.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -136.55 103.0 5.1 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.517 1.127 . . . . 0.0 108.162 -169.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.2 mm -138.59 140.88 38.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mp -132.58 -27.91 1.68 Allowed 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -169.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.2 160.88 24.22 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.77 114.42 1.36 Allowed 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.728 2.285 . . . . 0.0 111.15 174.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.39 12.5 72.85 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 118.137 -1.368 . . . . 0.0 114.19 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.86 127.15 63.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-N 119.722 1.761 . . . . 0.0 108.827 -174.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.71 169.46 12.52 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.61 1.564 . . . . 0.0 109.809 179.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 14.5 ttm -143.51 67.98 16.69 Favored Pre-proline 0 CA--C 1.536 0.436 0 O-C-N 121.926 -0.484 . . . . 0.0 111.295 176.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.06 149.4 53.27 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 121.297 1.331 . . . . 0.0 113.066 -174.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 174.15 153.44 0.11 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 128.582 2.753 . . . . 0.0 106.28 -169.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.85 166.1 24.09 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 125.988 1.715 . . . . 0.0 106.903 172.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -52.71 147.86 14.36 Favored Pre-proline 0 CA--C 1.536 0.421 0 CA-C-O 118.526 -0.749 . . . . 0.0 109.352 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -47.44 -42.13 28.65 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.794 2.33 . . . . 0.0 112.281 174.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -62.77 -13.8 37.37 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.491 1.116 . . . . 0.0 113.712 -177.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 71.6 m -78.28 -0.68 29.69 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.857 0.753 . . . . 0.0 111.827 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.54 15.03 2.26 Favored Glycine 0 C--N 1.336 0.53 0 CA-C-O 118.32 -1.267 . . . . 0.0 112.929 171.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.33 147.96 52.54 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 119.42 1.61 . . . . 0.0 109.549 169.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.1 mt -131.32 -33.5 1.48 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.519 1.128 . . . . 0.0 110.402 -174.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -145.5 156.69 43.87 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.516 1.527 . . . . 0.0 108.104 177.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.9 m -90.14 132.68 35.32 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 122.984 0.514 . . . . 0.0 110.365 -176.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.01 -176.17 43.08 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.739 1.161 . . . . 0.0 110.8 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 46.9 mtt -148.9 170.87 17.32 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.552 1.941 . . . . 0.0 110.284 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.42 162.67 40.12 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.085 1.754 . . . . 0.0 108.339 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.1 tp -146.42 122.45 10.74 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 126.207 1.803 . . . . 0.0 108.338 -172.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 74.2 m -137.25 143.79 42.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.373 1.069 . . . . 0.0 108.522 -171.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.2 tt -141.81 131.65 24.35 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 177.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -107.25 118.08 35.77 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 126.769 2.027 . . . . 0.0 107.018 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -59.49 -34.73 72.94 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.985 0.812 . . . . 0.0 112.45 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -96.67 -10.6 26.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.03 0.932 . . . . 0.0 112.097 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.73 179.97 11.88 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -169.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -149.23 161.38 5.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 169.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -109.02 118.02 35.72 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -169.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -79.84 153.67 75.4 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 123.798 0.839 . . . . 0.0 109.65 174.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -78.94 -3.68 13.39 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 123.379 2.719 . . . . 0.0 115.417 -169.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -150.49 35.51 0.95 Allowed Glycine 0 C--N 1.339 0.695 0 CA-C-N 119.357 0.981 . . . . 0.0 112.532 -172.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -135.78 154.18 51.3 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 171.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -65.97 -30.5 71.07 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -169.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -139.05 161.76 56.12 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.696 0.798 . . . . 0.0 111.834 -172.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.87 143.32 32.99 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 122.629 2.219 . . . . 0.0 110.204 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 30.6 mm -85.9 135.43 25.01 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -110.04 -16.35 13.83 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.379 -1.296 . . . . 0.0 111.069 172.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 40.7 tp -147.79 135.04 20.53 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 120.409 1.459 . . . . 0.0 110.429 -169.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.7 mp -138.99 136.99 35.96 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.307 1.043 . . . . 0.0 109.061 -172.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 4.0 mt -116.72 115.42 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.051 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 168.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.81 152.52 40.83 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 171.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -144.32 137.83 27.45 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 104.856 -2.276 . . . . 0.0 104.856 169.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 92.1 p -129.99 148.03 51.8 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.047 1.739 . . . . 0.0 107.412 169.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.84 136.6 23.13 Favored 'General case' 0 CA--C 1.513 -0.474 0 O-C-N 121.625 -0.672 . . . . 0.0 109.671 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.22 -21.35 60.66 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 123.525 0.515 . . . . 0.0 111.628 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -143.92 153.0 41.84 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.863 0.865 . . . . 0.0 109.738 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.43 -33.37 71.17 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -77.61 -31.04 52.64 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.306 0.957 . . . . 0.0 111.236 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.5 m -63.53 -37.99 89.42 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.901 -0.499 . . . . 0.0 109.701 169.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -47.7 84.37 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.191 0.996 . . . . 0.0 110.219 171.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.0 mm -58.38 -50.62 78.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.03 -39.2 93.99 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-N 119.115 0.871 . . . . 0.0 111.93 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.12 -52.66 32.31 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.567 1.147 . . . . 0.0 110.567 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.0 mm -50.81 -47.34 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 125.508 1.523 . . . . 0.0 108.671 173.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -66.55 -9.45 35.1 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.974 -1.079 . . . . 0.0 112.542 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -93.87 -48.5 6.25 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 124.204 1.002 . . . . 0.0 109.626 169.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.1 pp -72.39 -24.38 61.24 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 113.313 0.856 . . . . 0.0 113.313 -173.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 10.3 p -66.11 -21.69 66.36 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 123.124 0.57 . . . . 0.0 111.457 172.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -67.0 -21.25 65.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.246 0.93 . . . . 0.0 109.849 172.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 24.8 mt -96.82 -71.21 0.69 Allowed 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.12 0.968 . . . . 0.0 110.783 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 20.0 mt -69.06 -13.33 62.38 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 -169.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 31.2 m -100.22 27.26 5.77 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 120.243 1.383 . . . . 0.0 111.522 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -128.88 110.46 12.14 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.625 1.97 . . . . 0.0 106.104 172.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -60.24 -26.63 66.59 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.863 0.465 . . . . 0.0 111.453 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -62.93 -47.49 82.99 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 123.619 0.768 . . . . 0.0 109.676 175.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -65.52 -44.16 94.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 123.982 0.913 . . . . 0.0 109.092 176.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 48.2 mt -56.12 -43.39 78.12 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 118.632 0.651 . . . . 0.0 111.487 -175.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -67.74 -40.47 84.15 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 118.052 0.387 . . . . 0.0 110.462 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -69.64 -33.08 72.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 118.749 0.704 . . . . 0.0 110.214 -176.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 19.1 mt -68.3 -56.77 7.43 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 170.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 35.7 mt -55.41 -26.22 40.47 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -173.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 74.4 p -101.57 6.78 42.31 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.402 1.081 . . . . 0.0 112.338 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.31 112.7 1.65 Allowed 'General case' 0 C--N 1.342 0.264 0 C-N-CA 124.845 1.258 . . . . 0.0 110.493 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 7.4 m -70.0 -24.81 63.36 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.253 0.621 . . . . 0.0 112.054 177.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 15.5 m -150.59 158.97 44.77 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.111 0.964 . . . . 0.0 110.16 -169.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -51.15 -39.34 56.08 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.949 1.7 . . . . 0.0 111.1 176.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -57.25 -35.36 69.63 Favored 'General case' 0 C--O 1.227 -0.103 0 C-N-CA 123.13 0.572 . . . . 0.0 112.384 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -80.44 -27.71 37.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 119.426 1.012 . . . . 0.0 110.413 -177.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 27.4 mt -66.15 -50.44 63.93 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.526 1.057 . . . . 0.0 108.387 170.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.12 -33.75 67.68 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.934 0.894 . . . . 0.0 113.15 174.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.76 -42.53 99.73 Favored 'General case' 0 N--CA 1.463 0.177 0 O-C-N 121.209 -0.932 . . . . 0.0 110.868 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 96.6 mt -69.15 -35.41 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -179.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.1 mm -58.26 -53.82 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 169.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 24.7 m -63.96 -27.0 68.84 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 122.68 0.392 . . . . 0.0 111.578 -170.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -59.82 -27.38 66.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.663 1.585 . . . . 0.0 113.404 175.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.851 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 -174.64 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.486 1.354 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -67.05 112.39 4.36 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 104.873 -2.269 . . . . 0.0 104.873 168.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -48.53 -43.51 35.43 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.983 0.913 . . . . 0.0 110.377 -176.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.42 -24.36 1.94 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.685 1.994 . . . . 0.0 113.902 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -59.42 -26.85 65.51 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.291 0.951 . . . . 0.0 112.337 177.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -100.44 -15.86 17.77 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.098 0.959 . . . . 0.0 112.902 -174.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -103.09 98.32 11.52 Favored Pre-proline 0 N--CA 1.471 0.624 0 CA-C-N 120.879 1.672 . . . . 0.0 106.985 -173.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.5 -60.43 0.31 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.696 2.264 . . . . 0.0 113.434 -171.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.479 ' C ' ' H ' ' A' ' 11' ' ' SER . 54.9 tt0 -165.97 -87.02 0.02 OUTLIER 'General case' 0 C--O 1.232 0.157 0 C-N-CA 123.592 0.757 . . . . 0.0 111.621 -170.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.2 m -67.87 8.76 0.35 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.337 1.455 . . . . 0.0 111.754 176.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.479 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -65.63 -25.54 67.42 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.99 1.316 . . . . 0.0 111.905 -174.926 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.2 mp -98.23 140.0 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.975 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.0 m -154.39 158.36 39.91 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.483 0.659 . . . . 0.0 110.606 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.5 t -128.33 145.46 35.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 173.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mm -138.76 140.04 39.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 104.654 -2.351 . . . . 0.0 104.654 -169.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -71.34 -49.52 41.63 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 119.269 0.941 . . . . 0.0 109.303 171.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.0 p -159.4 144.24 15.48 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.5 156.87 25.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 169.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.7 ttpt -58.75 -42.07 87.99 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.878 0.471 . . . . 0.0 110.653 175.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -165.22 177.69 7.46 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 128.212 2.605 . . . . 0.0 107.214 173.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.81 -37.07 65.65 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.227 1.811 . . . . 0.0 114.036 175.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -62.6 -50.35 71.6 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 120.401 1.455 . . . . 0.0 108.687 173.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -60.55 -32.45 71.52 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 122.951 0.5 . . . . 0.0 111.416 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.36 -37.86 86.27 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 121.575 -0.703 . . . . 0.0 110.158 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.51 -47.28 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 170.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -58.03 -49.64 76.15 Favored 'General case' 0 C--N 1.334 -0.082 0 C-N-CA 123.222 0.609 . . . . 0.0 110.657 -174.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -62.82 -28.69 70.18 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.568 1.147 . . . . 0.0 111.626 174.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.2 m -76.51 -15.18 59.94 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.718 1.145 . . . . 0.0 112.766 177.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.94 -12.49 4.7 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -171.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -55.75 -34.19 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 120.525 1.511 . . . . 0.0 112.069 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.9 m -66.84 -41.61 87.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.385 -0.822 . . . . 0.0 110.253 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -65.74 -38.45 89.15 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 46.2 tp -60.65 -49.86 75.82 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.534 0.734 . . . . 0.0 110.316 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -64.92 -33.2 75.45 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.398 1.079 . . . . 0.0 112.221 -176.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -79.86 -0.37 34.47 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.654 1.182 . . . . 0.0 111.876 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 53.82 32.07 14.29 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.24 1.816 . . . . 0.0 113.284 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -68.31 -24.88 64.89 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 120.819 -1.175 . . . . 0.0 109.709 168.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.6 pt -144.07 168.72 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 126.235 1.814 . . . . 0.0 110.016 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.3 p -96.11 172.56 7.91 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.807 1.243 . . . . 0.0 109.845 169.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.27 -33.05 74.49 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.267 -0.896 . . . . 0.0 110.557 171.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -61.27 -40.25 93.41 Favored 'General case' 0 C--N 1.342 0.251 0 O-C-N 121.97 -0.456 . . . . 0.0 110.684 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -54.28 -49.48 69.49 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.009 0.524 . . . . 0.0 110.154 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 45.2 mt -59.72 -49.2 84.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 C-N-CA 123.644 0.778 . . . . 0.0 109.246 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -68.5 -26.87 65.68 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.165 -0.921 . . . . 0.0 111.995 -174.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.95 83.29 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.566 1.076 . . . . 0.0 110.683 171.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.06 -51.72 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -58.52 -44.03 89.36 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -175.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -64.28 -46.24 84.54 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.774 0.83 . . . . 0.0 111.275 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.0 m -64.05 -35.79 81.88 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.801 0.44 . . . . 0.0 110.76 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 96.8 m -63.31 -46.38 86.94 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.746 0.818 . . . . 0.0 109.827 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.03 -45.94 95.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 118.632 0.651 . . . . 0.0 109.698 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -71.69 -32.74 68.16 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -170.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -138.62 -56.46 0.63 Allowed 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.152 0.581 . . . . 0.0 111.058 -168.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 155.54 167.41 17.04 Favored Glycine 0 CA--C 1.531 1.071 0 N-CA-C 109.644 -1.383 . . . . 0.0 109.644 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -44.99 138.91 8.54 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.647 2.898 . . . . 0.0 112.79 176.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -52.17 -37.39 54.49 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.077 0.951 . . . . 0.0 112.827 -175.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -150.65 156.1 40.68 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 26.3 mm -137.04 140.03 43.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 102.643 -3.095 . . . . 0.0 102.643 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 30.7 mt -110.39 -40.46 4.64 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -168.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -168.38 165.03 7.82 Favored Pre-proline 0 C--O 1.236 0.384 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -169.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -47.92 113.03 0.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.827 2.351 . . . . 0.0 110.756 169.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.16 5.78 75.99 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 117.81 -1.55 . . . . 0.0 114.848 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 19.0 t -135.3 133.95 52.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-N 120.92 2.36 . . . . 0.0 109.524 -171.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.65 166.77 21.84 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.786 1.635 . . . . 0.0 110.281 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 33.5 ttp -147.5 82.44 8.13 Favored Pre-proline 0 C--O 1.225 -0.195 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 170.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -58.76 -91.21 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.312 0 C-N-CA 123.036 2.491 . . . . 0.0 114.43 -174.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . 0.301 0.2 OUTLIER 47.78 178.18 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.578 2.351 . . . . 0.0 114.753 -168.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.7 167.94 19.92 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 125.281 1.432 . . . . 0.0 107.848 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 25.1 mtm105 -60.74 150.57 75.61 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-O 118.575 -0.726 . . . . 0.0 109.046 174.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -45.63 -45.14 16.73 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.634 2.889 . . . . 0.0 112.755 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -61.71 -15.55 41.48 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.219 1.408 . . . . 0.0 113.643 -176.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.5 m -79.63 -4.72 52.91 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.518 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 131.49 18.64 1.27 Allowed Glycine 0 CA--C 1.523 0.579 0 CA-C-O 118.943 -0.92 . . . . 0.0 113.591 174.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.0 144.2 56.34 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 119.087 1.443 . . . . 0.0 107.645 169.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.9 mt -123.69 -32.63 3.3 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 124.313 1.045 . . . . 0.0 110.158 -173.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -143.19 170.85 14.97 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.415 1.886 . . . . 0.0 107.468 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 97.5 m -103.17 122.23 44.28 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.464 0.706 . . . . 0.0 110.381 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.11 -177.23 38.65 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 126.017 1.77 . . . . 0.0 111.052 -175.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 51.4 mtt -149.15 169.83 19.82 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.594 1.697 . . . . 0.0 112.065 -171.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.9 p -146.86 168.08 22.32 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.859 1.264 . . . . 0.0 109.793 174.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.5 tp -153.98 106.78 2.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.797 1.639 . . . . 0.0 106.795 -172.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 65.5 m -122.7 140.9 52.36 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 123.79 0.836 . . . . 0.0 108.77 -169.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.4 tt -133.67 130.47 38.26 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.3 mp -110.32 119.45 39.28 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.744 1.617 . . . . 0.0 107.924 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -63.1 -36.15 82.62 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.588 0.631 . . . . 0.0 112.178 -177.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -91.05 -17.1 26.79 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.811 1.245 . . . . 0.0 111.919 177.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 68.1 -179.93 18.18 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -168.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.74 162.94 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 169.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -121.09 83.82 2.14 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 122.295 1.045 . . . . 0.0 110.605 -169.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -50.71 143.96 13.74 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 114.317 -1.31 . . . . 0.0 112.212 174.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -67.94 152.78 76.63 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.107 1.871 . . . . 0.0 109.945 169.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.9 -44.37 2.32 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 125.316 1.436 . . . . 0.0 112.422 176.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.18 140.67 31.7 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.895 2.078 . . . . 0.0 110.55 169.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -73.73 -41.63 62.28 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -169.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -146.52 151.72 43.88 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 124.737 1.215 . . . . 0.0 110.194 -175.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -61.94 155.15 56.9 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.155 2.57 . . . . 0.0 112.593 -169.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 47.5 mm -112.43 136.95 47.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 C-N-CA 124.735 1.214 . . . . 0.0 107.876 -171.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -113.74 -9.71 13.12 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 117.192 -1.385 . . . . 0.0 110.973 175.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.9 mt -136.37 138.94 42.12 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 120.582 1.537 . . . . 0.0 111.309 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.5 mp -137.02 101.46 4.57 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.7 mp -77.05 146.43 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 169.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.06 23.68 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 109.035 -1.626 . . . . 0.0 109.035 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 1.1 tt -155.04 150.0 26.79 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 -171.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.0 p -143.0 141.95 31.48 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 127.226 2.211 . . . . 0.0 105.084 169.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -149.23 130.22 14.37 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -173.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.29 -22.96 57.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 123.399 0.437 . . . . 0.0 111.428 -175.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -139.41 155.76 47.42 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.778 0.831 . . . . 0.0 110.32 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.87 -34.24 71.4 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.684 0.793 . . . . 0.0 112.973 -177.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -77.28 -32.16 55.34 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.1 0.864 . . . . 0.0 111.102 177.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.3 m -60.48 -41.7 94.78 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 169.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.36 -47.3 84.24 Favored 'General case' 0 C--O 1.225 -0.21 0 C-N-CA 124.68 1.192 . . . . 0.0 110.71 173.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 15.1 mm -59.69 -53.03 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -63.14 -37.04 94.27 Favored Glycine 0 CA--C 1.528 0.891 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 -177.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.0 -50.77 63.11 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.641 1.177 . . . . 0.0 110.53 177.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 mm -54.71 -45.54 73.19 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.28 -10.32 59.56 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.674 0.79 . . . . 0.0 113.056 -177.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.23 -42.5 14.62 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 169.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 83.8 mt -63.77 -32.99 74.67 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 117.804 -1.093 . . . . 0.0 110.2 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 13.8 m -51.17 -28.88 12.23 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 171.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -67.9 -22.82 65.06 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.634 1.106 . . . . 0.0 110.845 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 49.6 mt -108.03 -60.81 1.67 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.744 1.218 . . . . 0.0 109.874 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.14 -38.73 58.48 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 127.679 2.392 . . . . 0.0 114.19 178.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 56.5 m -95.06 24.99 4.45 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.481 1.037 . . . . 0.0 111.664 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -133.32 101.91 5.35 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 124.101 0.96 . . . . 0.0 108.808 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -58.16 -28.55 64.83 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.801 -179.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.35 -43.15 91.75 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.278 0.631 . . . . 0.0 110.049 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.56 -44.4 86.44 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.8 mt -56.29 -37.88 70.47 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 119.101 0.864 . . . . 0.0 111.319 -176.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -68.35 -40.33 81.57 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 118.907 0.776 . . . . 0.0 111.109 175.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -69.03 -34.76 75.75 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 118.797 0.726 . . . . 0.0 109.805 -177.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -65.96 -55.15 18.3 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 169.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 35.0 mt -56.19 -16.11 4.79 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.901 1.075 . . . . 0.0 113.901 -176.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 42.8 p -112.0 7.62 19.91 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.95 1.3 . . . . 0.0 110.806 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.49 117.78 6.16 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.631 1.572 . . . . 0.0 110.348 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 19.8 m -76.99 -15.36 59.66 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.721 0.808 . . . . 0.0 112.157 175.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 73.5 p -154.92 164.65 38.56 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 119.035 0.834 . . . . 0.0 110.986 -170.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -58.09 -37.11 73.88 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.856 0.862 . . . . 0.0 109.494 169.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -57.91 -45.53 86.35 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 122.659 0.384 . . . . 0.0 110.455 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.68 -33.87 76.9 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.3 mt -67.55 -51.49 50.14 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.065 0.848 . . . . 0.0 109.074 175.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.72 -24.4 67.76 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.096 0.958 . . . . 0.0 113.511 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -61.07 -44.67 97.02 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 120.712 -1.243 . . . . 0.0 109.776 172.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 89.9 mt -67.35 -35.51 73.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.166 0.986 . . . . 0.0 109.368 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 41.2 mm -56.22 -53.77 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 169.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 20.3 m -64.66 -33.02 74.95 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 123.642 0.589 . . . . 0.0 110.624 -171.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -58.51 -45.06 89.55 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.779 1.631 . . . . 0.0 112.707 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.038 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 -169.785 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 tpt . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -65.91 110.11 2.76 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 168.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.38 -41.11 65.58 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.618 0.767 . . . . 0.0 110.447 -175.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.4 p -53.26 -21.62 5.68 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.583 1.553 . . . . 0.0 113.549 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -59.82 -25.0 64.61 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.664 1.12 . . . . 0.0 112.264 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -100.72 -10.97 20.33 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 117.57 -1.205 . . . . 0.0 113.126 -174.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -113.78 83.32 7.3 Favored Pre-proline 0 N--CA 1.474 0.768 0 CA-C-N 121.52 1.964 . . . . 0.0 107.479 -174.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -55.74 -54.18 4.53 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.864 3.042 . . . . 0.0 116.277 -169.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.529 ' C ' ' H ' ' A' ' 11' ' ' SER . 42.0 tt0 -157.88 -93.34 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.573 0.624 . . . . 0.0 112.589 -169.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 m -68.52 13.43 0.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.432 1.493 . . . . 0.0 111.365 177.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.529 ' H ' ' C ' ' A' ' 9' ' ' GLU . 11.2 m -62.03 -29.17 70.1 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.448 1.499 . . . . 0.0 111.229 -169.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.3 mp -105.84 129.93 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 -175.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 31.1 m -144.2 141.56 29.97 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 123.388 0.43 . . . . 0.0 110.351 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.4 t -112.6 135.41 52.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 169.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.421 HG23 ' H ' ' A' ' 17' ' ' SER . 30.9 mt -136.75 145.52 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -169.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.442 ' CE1' HE22 ' A' ' 86' ' ' GLN . 32.5 t-80 -59.4 -46.29 89.11 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.99 0.916 . . . . 0.0 111.82 174.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.421 ' H ' HG23 ' A' ' 15' ' ' ILE . 18.5 p -168.14 150.94 5.56 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.541 1.136 . . . . 0.0 108.161 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.21 144.26 30.8 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 168.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tppt? -72.32 -30.01 64.36 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 122.096 -0.378 . . . . 0.0 111.955 -175.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -163.81 173.18 13.1 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 127.388 2.275 . . . . 0.0 106.123 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -66.6 -33.95 76.8 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 119.252 -0.404 . . . . 0.0 110.504 169.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.404 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.4 mt-30 -59.06 -48.03 83.09 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 169.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -65.54 -33.56 76.21 Favored 'General case' 0 C--O 1.223 -0.292 0 O-C-N 121.788 -0.57 . . . . 0.0 111.52 -178.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.61 -37.77 88.6 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 121.81 -0.556 . . . . 0.0 109.686 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.1 -45.85 85.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -56.87 -44.95 82.75 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.035 0.534 . . . . 0.0 110.426 -174.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -67.62 -32.79 73.75 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 118.101 -0.952 . . . . 0.0 111.734 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.3 m -61.99 -21.16 64.61 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.64 1.109 . . . . 0.0 112.274 173.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.6 mmt -122.2 -23.94 5.2 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 -169.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -59.5 -34.57 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 120.912 1.687 . . . . 0.0 112.272 -170.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.1 m -63.1 -29.64 70.96 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.34 0.973 . . . . 0.0 111.723 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 71.5 mt -81.07 -40.66 23.8 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.153 0.981 . . . . 0.0 109.265 174.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.5 tp -56.58 -40.71 75.7 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.711 0.804 . . . . 0.0 110.628 177.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -66.54 -27.96 68.16 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 124.918 1.287 . . . . 0.0 113.068 -172.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -101.87 16.95 24.35 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 117.971 0.351 . . . . 0.0 110.486 173.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.423 0.0 OUTLIER 44.28 42.66 5.36 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.26 2.224 . . . . 0.0 115.807 -170.122 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -68.14 -19.29 64.81 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 120.974 -1.079 . . . . 0.0 110.193 168.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.9 pt -143.26 174.14 5.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 127.081 2.152 . . . . 0.0 108.125 -176.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 m -111.75 159.22 18.47 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.007 1.723 . . . . 0.0 107.722 171.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -60.99 -30.65 70.4 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.971 -1.08 . . . . 0.0 111.901 -176.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -57.97 -36.73 73.0 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.705 -0.622 . . . . 0.0 111.92 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -60.3 -45.11 94.51 Favored 'General case' 0 CA--C 1.527 0.09 0 C-N-CA 123.681 0.792 . . . . 0.0 110.015 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.8 mt -59.1 -51.05 77.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 124.725 1.21 . . . . 0.0 108.481 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.8 tp60 -67.97 -26.0 65.71 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.026 -0.988 . . . . 0.0 111.775 -175.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.33 -43.36 96.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 119.771 1.168 . . . . 0.0 110.658 173.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.2 mt -67.74 -48.81 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.404 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.4 mttt -59.34 -45.5 91.19 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.195 0.452 . . . . 0.0 109.841 -175.717 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.3 -42.78 96.21 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 124.222 1.009 . . . . 0.0 111.106 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.0 m -64.36 -42.9 95.97 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.135 0.425 . . . . 0.0 110.235 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 98.3 m -58.79 -44.01 90.61 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.573 1.149 . . . . 0.0 111.022 176.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 65.8 mt -68.35 -40.27 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 123.753 0.821 . . . . 0.0 109.979 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -64.37 -34.67 78.7 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.838 0.855 . . . . 0.0 113.019 -173.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -146.41 -54.02 0.25 Allowed 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 122.87 0.468 . . . . 0.0 111.149 -168.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 160.61 168.13 22.09 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -47.09 145.34 7.6 Favored 'Trans proline' 0 N--CA 1.459 -0.548 0 C-N-CA 123.203 2.602 . . . . 0.0 113.19 173.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -103.73 -8.58 19.76 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.979 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -142.59 83.3 1.81 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.41 1.084 . . . . 0.0 108.376 -169.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.3 mm -125.65 127.02 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 103.713 -2.699 . . . . 0.0 103.713 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.9 mp -120.15 -21.99 6.8 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -169.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.56 159.36 31.72 Favored Pre-proline 0 C--O 1.236 0.368 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 170.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -62.24 104.83 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 121.682 1.588 . . . . 0.0 108.99 170.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.56 -10.04 16.68 Favored Glycine 0 CA--C 1.533 1.176 0 CA-C-O 117.958 -1.468 . . . . 0.0 113.973 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.8 t -132.91 123.06 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 119.632 1.716 . . . . 0.0 108.863 -170.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -117.73 167.17 11.61 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 126.114 1.766 . . . . 0.0 109.12 174.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.9 ttm -137.58 60.25 24.68 Favored Pre-proline 0 CA--C 1.548 0.888 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 177.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -53.53 141.79 61.63 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.262 1.975 . . . . 0.0 114.429 -172.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -175.75 156.66 1.88 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.552 2.741 . . . . 0.0 106.753 -171.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.62 162.03 33.86 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.863 1.665 . . . . 0.0 107.366 169.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -52.52 141.94 32.62 Favored Pre-proline 0 CA--C 1.537 0.454 0 CA-C-O 117.676 -1.154 . . . . 0.0 108.868 176.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -45.69 -41.13 19.29 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.818 3.012 . . . . 0.0 112.916 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -62.2 -13.06 23.73 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.465 1.506 . . . . 0.0 113.253 -177.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 62.1 m -78.25 -1.82 34.85 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.649 0.78 . . . . 0.0 111.583 177.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.41 17.46 2.4 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-O 118.433 -1.204 . . . . 0.0 112.96 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.58 145.83 55.58 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.3 1.55 . . . . 0.0 108.724 169.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.1 mt -128.46 -32.28 2.2 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 124.471 1.109 . . . . 0.0 110.425 -173.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -145.26 160.86 40.84 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.605 1.562 . . . . 0.0 108.438 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 82.2 m -94.54 127.76 40.7 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 123.195 0.598 . . . . 0.0 110.091 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -170.82 -176.45 40.12 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 125.204 1.383 . . . . 0.0 110.683 -175.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 49.2 mtt -148.26 171.81 15.36 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.095 1.758 . . . . 0.0 111.059 -174.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -139.15 168.25 20.25 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.131 1.773 . . . . 0.0 108.586 174.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.3 tp -148.77 83.31 1.46 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.699 2.0 . . . . 0.0 107.397 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 55.7 m -86.51 142.57 28.25 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 176.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.2 tt -136.59 116.9 13.58 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 169.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -89.1 132.24 34.89 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 172.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.06 -29.24 70.12 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 169.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.442 HE22 ' CE1' ' A' ' 16' ' ' HIS . 32.1 mt-30 -130.29 75.66 1.67 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.645 1.978 . . . . 0.0 107.331 -178.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -52.12 161.45 2.17 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 125.949 1.738 . . . . 0.0 113.835 175.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 48.9 t -127.6 147.58 32.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 C-N-CA 125.745 1.618 . . . . 0.0 107.426 -173.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -98.65 179.14 4.77 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -131.37 156.47 80.09 Favored Pre-proline 0 C--N 1.323 -0.558 0 C-N-CA 124.162 0.985 . . . . 0.0 111.744 -169.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -63.95 -1.95 4.06 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 123.475 2.783 . . . . 0.0 115.292 -174.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -143.73 23.62 2.14 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 124.339 0.971 . . . . 0.0 112.849 171.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -151.1 98.15 2.53 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 170.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -66.11 -23.33 66.48 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.901 1.281 . . . . 0.0 114.299 -169.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -75.94 131.73 75.57 Favored Pre-proline 0 N--CA 1.436 -1.164 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 177.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.05 154.9 42.58 Favored 'Trans proline' 0 N--CA 1.448 -1.17 0 C-N-CA 122.218 1.945 . . . . 0.0 110.493 176.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 49.6 mm -117.35 124.72 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -88.86 -33.34 17.38 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 117.178 -1.391 . . . . 0.0 109.434 169.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 mt -116.19 131.11 57.04 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-N 120.034 1.288 . . . . 0.0 112.025 -169.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mp -136.84 104.99 5.66 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.9 mp -87.51 112.34 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 175.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.18 153.88 47.15 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 172.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.27 133.97 19.97 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 169.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 93.0 p -127.62 147.69 50.36 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 126.344 1.858 . . . . 0.0 106.925 168.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -147.25 132.87 18.79 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -178.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.16 -22.74 60.44 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.721 0.408 . . . . 0.0 111.962 179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -144.42 155.82 43.93 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.678 0.791 . . . . 0.0 110.036 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.36 74.87 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.22 -31.22 62.53 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 120.839 -1.163 . . . . 0.0 111.032 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.7 m -64.65 -39.05 93.01 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.937 -0.477 . . . . 0.0 110.136 170.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -58.84 -48.84 79.92 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 123.637 0.775 . . . . 0.0 109.873 172.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 16.0 mm -55.92 -53.83 33.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.25 -39.28 94.39 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 118.837 0.744 . . . . 0.0 112.03 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.96 -53.3 27.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.459 1.104 . . . . 0.0 110.582 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -51.35 -47.44 34.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.47 1.508 . . . . 0.0 108.637 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -67.62 -10.66 54.13 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.499 1.12 . . . . 0.0 112.555 -177.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -93.87 -46.17 7.31 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 123.973 0.909 . . . . 0.0 109.726 169.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.8 pp -72.66 -25.24 61.19 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 118.711 0.687 . . . . 0.0 112.108 -173.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.9 p -61.18 -20.91 63.29 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.177 0.591 . . . . 0.0 112.152 172.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -65.7 -19.17 65.8 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.391 0.996 . . . . 0.0 110.098 172.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 36.5 mt -106.54 -63.29 1.29 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.639 1.576 . . . . 0.0 110.178 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.5 -23.85 59.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.533 1.933 . . . . 0.0 114.528 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.0 m -112.48 28.15 9.03 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 118.95 0.796 . . . . 0.0 110.165 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -132.89 102.57 5.69 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.863 0.865 . . . . 0.0 108.903 177.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -57.85 -26.92 62.72 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.938 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -62.09 -45.0 95.45 Favored 'General case' 0 C--N 1.34 0.152 0 C-N-CA 123.893 0.877 . . . . 0.0 110.123 174.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -69.06 -46.35 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 CA-C-O 117.961 -1.019 . . . . 0.0 108.728 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 8.8 mp -50.56 -44.18 56.57 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 119.541 1.064 . . . . 0.0 112.672 -176.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -71.25 -34.38 70.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 118.63 0.65 . . . . 0.0 110.384 -178.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -72.76 -34.43 67.0 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 121.404 -0.81 . . . . 0.0 109.68 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 55.7 mt -65.6 -53.47 41.27 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.9 mt -56.78 -32.43 65.64 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -174.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 37.2 p -88.24 -0.53 57.22 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.076 0.95 . . . . 0.0 112.26 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.87 138.64 57.22 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 119.127 0.876 . . . . 0.0 110.178 176.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.0 m -124.57 9.07 8.35 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.943 1.297 . . . . 0.0 110.754 176.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 74.8 p -152.16 153.66 34.31 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.491 1.116 . . . . 0.0 108.916 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -62.21 -32.12 72.74 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -58.07 -40.99 82.42 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.191 0.597 . . . . 0.0 111.842 176.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 14.3 tp60 -74.56 -30.89 61.91 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 119.429 1.013 . . . . 0.0 110.738 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.77 -50.15 52.82 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.407 1.003 . . . . 0.0 108.924 173.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.36 -31.1 65.41 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.515 1.126 . . . . 0.0 112.892 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -61.93 -45.85 91.88 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 120.842 -1.161 . . . . 0.0 110.038 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 95.7 mt -65.49 -37.2 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 123.987 0.915 . . . . 0.0 109.739 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 40.2 mm -56.24 -49.56 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-N 118.23 0.468 . . . . 0.0 110.128 169.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 39.2 m -66.84 -26.26 66.83 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -169.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -67.41 -34.86 78.11 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.776 0.717 . . . . 0.0 111.252 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.926 0 CA-C-O 117.815 -1.547 . . . . 0.0 110.375 -169.257 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tpp . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.705 0.288 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.34 106.45 1.71 Allowed 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 169.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.4 -42.9 96.88 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 175.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -56.03 -24.04 36.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.41 1.084 . . . . 0.0 112.773 -178.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.81 -22.68 66.8 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.097 0.862 . . . . 0.0 112.688 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -106.0 -10.2 16.69 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-O 116.52 -1.705 . . . . 0.0 113.593 -170.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -115.47 91.01 27.34 Favored Pre-proline 0 N--CA 1.477 0.925 0 CA-C-N 122.729 2.513 . . . . 0.0 108.433 -174.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -42.07 -75.07 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.804 1 C-N-CA 125.537 4.158 . . . . 0.0 116.795 -171.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.514 ' C ' ' H ' ' A' ' 11' ' ' SER . 8.0 tp10 -162.09 -76.69 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 124.032 0.933 . . . . 0.0 111.114 -173.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.1 m -66.86 6.35 0.51 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.544 1.537 . . . . 0.0 111.803 175.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.514 ' H ' ' C ' ' A' ' 9' ' ' GLU . 3.8 m -74.91 1.52 12.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 128.452 2.701 . . . . 0.0 113.247 -169.04 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.5 mt -130.69 131.82 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 -172.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.5 p -151.61 155.6 38.73 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 122.052 0.929 . . . . 0.0 111.347 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -127.59 136.1 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 103.297 -2.853 . . . . 0.0 103.297 169.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.1 mt -134.89 147.39 29.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 106.46 -1.682 . . . . 0.0 106.46 -169.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -63.24 -47.93 80.37 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.938 -0.476 . . . . 0.0 110.631 174.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 p -166.51 147.42 6.23 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -172.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.15 149.89 30.39 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 169.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -60.19 -41.03 92.07 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.02 0.528 . . . . 0.0 110.818 178.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -166.02 179.9 5.55 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 127.09 2.156 . . . . 0.0 107.658 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -64.61 -31.6 72.89 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.021 0.929 . . . . 0.0 112.567 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.411 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.2 mt-30 -62.95 -49.43 74.76 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 120.265 1.393 . . . . 0.0 107.872 169.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.47 -34.77 74.51 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 121.887 -0.508 . . . . 0.0 111.67 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.63 -35.52 79.85 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.936 -0.478 . . . . 0.0 110.124 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -71.27 -45.85 68.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 172.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -55.58 -44.71 77.17 Favored 'General case' 0 C--O 1.225 -0.203 0 O-C-N 121.747 -0.596 . . . . 0.0 110.8 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -65.76 -33.35 75.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.753 174.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.5 m -63.32 -19.91 65.03 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.638 1.108 . . . . 0.0 112.479 172.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.8 mmt -124.68 -20.97 4.92 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -168.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -59.66 -36.99 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 120.788 1.631 . . . . 0.0 111.916 -169.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.3 m -66.57 -19.79 65.86 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.941 0.791 . . . . 0.0 112.183 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.9 mt -86.03 -44.44 12.3 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 123.927 0.891 . . . . 0.0 109.072 170.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -56.38 -42.92 78.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.959 0.904 . . . . 0.0 110.772 -178.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -67.59 -23.03 65.34 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 125.758 1.623 . . . . 0.0 113.942 -170.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -115.38 26.44 10.07 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 122.558 0.343 . . . . 0.0 110.454 171.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 60.89 27.15 17.0 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 170.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -67.21 -22.15 65.73 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.133 -0.979 . . . . 0.0 110.814 169.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 pt -143.35 170.27 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 126.165 1.786 . . . . 0.0 108.879 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.6 m -102.63 158.79 15.99 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.304 1.841 . . . . 0.0 108.385 171.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.29 -32.43 70.03 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.227 -0.92 . . . . 0.0 112.372 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -58.23 -32.83 68.7 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.764 -0.585 . . . . 0.0 111.954 175.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -60.74 -42.65 97.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.586 0.754 . . . . 0.0 110.435 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -59.69 -50.8 78.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.3 tp60 -69.11 -27.58 65.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.59 -0.719 . . . . 0.0 111.915 -173.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.17 -40.98 78.39 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.016 0.826 . . . . 0.0 110.757 174.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.5 mt -72.6 -49.23 42.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.411 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 90.8 mttt -58.36 -41.24 84.27 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 119.448 -0.31 . . . . 0.0 110.443 -175.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -59.39 -52.74 64.32 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.463 0.705 . . . . 0.0 111.051 -173.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.5 m -64.64 -40.69 95.91 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.789 0.436 . . . . 0.0 110.481 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.1 m -56.0 -39.23 71.58 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 119.098 -0.477 . . . . 0.0 111.671 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 90.3 mt -81.39 -47.03 20.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-N 118.808 0.731 . . . . 0.0 109.75 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -74.31 -31.97 62.69 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -169.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -126.63 -44.25 1.68 Allowed 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.005 0.922 . . . . 0.0 110.844 -169.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 138.0 163.53 9.65 Favored Glycine 0 CA--C 1.529 0.965 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -177.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -61.08 147.93 94.29 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.122 1.881 . . . . 0.0 109.599 176.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -135.05 12.72 3.6 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -169.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -134.01 75.64 1.61 Allowed 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 125.293 1.437 . . . . 0.0 107.483 169.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 50.2 mm -119.66 139.0 48.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 177.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mp -130.77 -25.18 2.35 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -169.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -158.5 161.86 27.74 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 173.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -48.64 118.38 3.34 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.775 2.317 . . . . 0.0 110.807 169.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.98 3.19 88.0 Favored Glycine 0 CA--C 1.533 1.199 0 CA-C-O 117.799 -1.556 . . . . 0.0 114.931 178.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 26.2 t -132.03 126.19 56.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-N 120.067 1.934 . . . . 0.0 108.882 -172.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.07 168.38 15.43 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.155 1.782 . . . . 0.0 109.768 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.4 ttm -137.31 60.41 26.97 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.035 0.934 . . . . 0.0 110.397 175.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -57.13 123.57 14.14 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 121.911 1.741 . . . . 0.0 110.362 -174.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.54 161.41 3.27 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.546 2.338 . . . . 0.0 106.855 -169.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -136.43 173.67 11.46 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.99 1.316 . . . . 0.0 109.343 -173.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 67.3 mtp85 -59.04 154.71 37.73 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 118.702 -0.666 . . . . 0.0 109.608 172.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.13 -39.59 84.08 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.204 1.936 . . . . 0.0 109.517 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -64.12 -12.92 44.12 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.558 1.543 . . . . 0.0 113.196 -177.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 73.6 m -77.17 -3.24 38.5 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.079 0.854 . . . . 0.0 111.784 177.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.85 19.6 1.98 Allowed Glycine 0 C--N 1.336 0.568 0 CA-C-O 118.245 -1.308 . . . . 0.0 112.689 173.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.75 145.32 56.13 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 119.502 1.651 . . . . 0.0 108.984 169.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -130.34 -30.57 1.92 Allowed 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 124.0 0.92 . . . . 0.0 111.047 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 mttt -148.04 155.6 41.68 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.939 1.296 . . . . 0.0 107.93 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 89.8 m -87.37 130.65 34.56 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 122.957 0.503 . . . . 0.0 111.592 -176.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -177.04 -177.98 46.4 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 125.173 1.368 . . . . 0.0 110.82 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 13.3 mtm -149.99 171.83 16.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 127.195 2.198 . . . . 0.0 109.731 -176.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.2 m -151.09 167.95 26.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.705 1.202 . . . . 0.0 109.273 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.7 tp -144.94 98.87 3.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 126.445 1.898 . . . . 0.0 108.468 -169.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 28.1 m -103.97 143.47 32.83 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.408 1.083 . . . . 0.0 108.69 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.4 tt -133.84 134.29 42.61 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 171.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -103.24 133.82 47.69 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.045 0.938 . . . . 0.0 108.653 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -67.62 -29.61 68.98 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 168.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -130.71 82.53 2.06 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 127.099 2.16 . . . . 0.0 106.796 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -46.98 157.61 0.53 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 113.083 -1.871 . . . . 0.0 113.743 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 95.5 t -123.8 150.68 28.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 -174.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -112.19 98.46 7.33 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.107 0.963 . . . . 0.0 110.663 -168.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -51.63 141.67 24.75 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 124.322 1.049 . . . . 0.0 110.827 169.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -73.1 68.27 4.06 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.165 3.244 . . . . 0.0 112.665 -176.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 167.8 -9.48 0.05 OUTLIER Glycine 0 CA--C 1.533 1.218 0 CA-C-O 118.719 -1.045 . . . . 0.0 114.467 173.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -71.74 -176.39 1.63 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.319 1.559 . . . . 0.0 110.384 172.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -93.81 -27.99 16.14 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.367 -0.833 . . . . 0.0 111.043 169.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -150.38 167.7 12.48 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.328 1.051 . . . . 0.0 112.805 -173.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -60.38 143.73 99.49 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 123.522 2.815 . . . . 0.0 112.49 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 25.5 mm -92.46 131.38 39.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 173.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -101.06 -19.31 15.86 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 116.351 -1.785 . . . . 0.0 110.923 169.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.7 mt -130.48 134.35 47.01 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 121.513 1.961 . . . . 0.0 111.887 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.7 mp -139.86 109.78 6.41 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -174.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.8 mp -92.34 119.23 39.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 175.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.36 153.03 34.9 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 170.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -151.38 143.55 24.01 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 170.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 79.4 p -142.73 146.31 34.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 168.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.463 ' HA ' ' HA ' ' A' ' 77' ' ' THR . . . -144.91 145.94 31.79 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 118.915 0.78 . . . . 0.0 109.716 170.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.69 -13.11 59.71 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.538 -0.465 . . . . 0.0 111.351 -176.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -137.04 151.26 48.72 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.63 0.772 . . . . 0.0 110.024 175.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.51 77.54 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -177.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -72.34 -30.03 64.37 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.119 -0.988 . . . . 0.0 110.946 176.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.0 m -66.94 -35.55 80.24 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.79 -0.569 . . . . 0.0 110.444 169.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 28.5 m-70 -62.19 -45.0 95.34 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.343 0.974 . . . . 0.0 109.85 170.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.1 mm -56.32 -52.03 56.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 118.946 0.794 . . . . 0.0 109.267 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.37 -39.69 95.08 Favored Glycine 0 CA--C 1.529 0.939 0 CA-C-N 118.945 0.793 . . . . 0.0 111.81 -177.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.86 67.46 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.411 0.684 . . . . 0.0 110.874 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.6 mm -58.04 -46.23 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 C-N-CA 124.607 1.163 . . . . 0.0 108.167 176.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -68.21 -12.04 60.29 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.139 -0.975 . . . . 0.0 111.527 -177.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.57 -48.58 6.54 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 124.276 1.031 . . . . 0.0 109.546 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 4.2 pp -68.83 -28.3 66.61 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.643 -177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.7 m -61.7 -20.21 63.22 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 118.822 -0.609 . . . . 0.0 112.393 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -67.19 -14.49 62.95 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.611 1.096 . . . . 0.0 110.734 171.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 32.6 mt -111.68 -59.51 1.97 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.683 1.593 . . . . 0.0 110.734 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.1 -37.25 74.16 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.669 1.188 . . . . 0.0 113.125 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 42.3 m -100.7 25.46 7.84 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.557 0.343 . . . . 0.0 110.679 -172.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -133.95 99.08 4.33 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 124.676 1.191 . . . . 0.0 108.121 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -57.04 -27.28 61.53 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.476 0.71 . . . . 0.0 112.309 -178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -64.0 -43.14 96.56 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.277 0.631 . . . . 0.0 110.065 175.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.3 mp -70.6 -42.83 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.2 mt -53.6 -40.43 65.68 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 119.247 0.93 . . . . 0.0 112.262 -175.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -71.56 -33.99 69.59 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 118.847 0.748 . . . . 0.0 110.569 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -72.31 -33.74 67.6 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 121.418 -0.801 . . . . 0.0 109.733 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -66.19 -53.92 31.5 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 26.8 mt -55.78 -30.22 60.95 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.136 0.574 . . . . 0.0 112.54 -174.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 32.1 p -91.56 2.86 56.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.273 1.029 . . . . 0.0 112.131 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.81 104.26 0.81 Allowed 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.465 1.106 . . . . 0.0 110.564 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 11.7 m -69.05 -26.61 65.05 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.37 0.668 . . . . 0.0 111.78 175.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.9 m -148.17 159.28 44.11 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.271 1.428 . . . . 0.0 108.954 -172.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -54.43 -31.66 55.8 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.36 1.464 . . . . 0.0 112.021 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -56.05 -34.46 65.92 Favored 'General case' 0 C--O 1.227 -0.083 0 C-N-CA 123.298 0.639 . . . . 0.0 112.616 -177.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -80.98 -26.47 36.51 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 119.451 1.023 . . . . 0.0 110.547 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 82.1 mt -71.07 -48.86 50.18 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 173.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -54.85 -38.55 67.6 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.893 1.277 . . . . 0.0 112.711 171.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -59.16 -47.73 84.24 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 118.941 0.791 . . . . 0.0 110.196 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 67.2 mt -65.91 -37.01 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 123.537 0.735 . . . . 0.0 110.292 -178.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 20.9 mm -57.32 -53.55 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 169.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 83.8 p -64.01 -29.5 70.65 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.129 0.49 . . . . 0.0 111.989 -169.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -57.93 -26.39 62.16 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.331 1.852 . . . . 0.0 113.342 176.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.876 0 N-CA-C 108.538 -1.825 . . . . 0.0 108.538 -177.684 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.3 tpt . . . . . 0 N--CA 1.488 1.433 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -67.15 114.56 6.0 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 169.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.32 -38.58 68.88 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 125.037 1.335 . . . . 0.0 110.038 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.86 -20.94 9.83 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.442 1.497 . . . . 0.0 112.891 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.84 -31.92 71.25 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 119.088 0.858 . . . . 0.0 112.508 175.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -87.08 -27.14 23.32 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 118.486 -0.768 . . . . 0.0 112.765 -171.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -91.42 104.31 9.66 Favored Pre-proline 0 CA--C 1.542 0.651 0 N-CA-C 103.801 -2.666 . . . . 0.0 103.801 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -63.46 -68.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.099 1.866 . . . . 0.0 113.686 -168.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -164.09 161.16 22.27 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.358 1.863 . . . . 0.0 106.38 171.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.0 m 53.07 22.87 2.7 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.34 1.056 . . . . 0.0 112.949 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.4 m -114.56 24.05 12.19 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 125.406 1.482 . . . . 0.0 110.691 -169.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.8 mt -131.52 129.69 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 103.863 -2.643 . . . . 0.0 103.863 178.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 m -150.38 149.24 29.8 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.475 0.71 . . . . 0.0 111.109 -173.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.7 t -123.65 142.61 39.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 169.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.6 mt -142.27 148.91 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 126.316 1.846 . . . . 0.0 106.168 -169.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -73.6 -46.58 46.23 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.553 -0.717 . . . . 0.0 109.911 172.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 p -163.21 144.47 9.57 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.54 158.61 33.44 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 169.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -58.18 -42.01 85.13 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.894 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -167.26 -177.43 3.66 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 127.931 2.492 . . . . 0.0 107.546 172.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -63.26 -33.18 74.95 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.462 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.6 mt-30 -60.29 -49.75 76.38 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 120.558 1.526 . . . . 0.0 107.433 173.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -61.88 -34.06 75.34 Favored 'General case' 0 C--O 1.221 -0.396 0 O-C-N 121.588 -0.695 . . . . 0.0 111.378 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.23 -32.01 71.91 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.658 -0.651 . . . . 0.0 111.262 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -46.4 82.84 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 171.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -56.51 -44.88 81.16 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.724 -0.61 . . . . 0.0 110.096 176.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -68.63 -13.92 62.68 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.216 -0.928 . . . . 0.0 113.083 174.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.5 m -82.96 -17.54 43.15 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.664 1.574 . . . . 0.0 111.592 169.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 3.3 mmt -130.35 -16.65 3.48 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -168.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.6 p -56.28 -37.02 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 120.173 1.351 . . . . 0.0 113.07 -169.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.2 m -68.33 -29.8 68.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.049 0.84 . . . . 0.0 111.645 -178.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 mt -75.91 -41.14 52.76 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 172.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.3 tp -58.46 -45.72 88.01 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.389 0.676 . . . . 0.0 110.568 179.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -60.15 -35.5 75.45 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.523 1.129 . . . . 0.0 112.118 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -96.54 17.25 16.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.738 -177.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.287 3.5 p30 43.06 38.17 1.39 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.941 1.696 . . . . 0.0 113.502 -176.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -73.21 -18.05 61.29 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 168.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.9 pt -145.98 166.95 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 127.113 2.165 . . . . 0.0 108.522 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 p -94.84 165.03 12.67 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.52 1.128 . . . . 0.0 109.24 169.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.99 -35.64 75.45 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.279 -0.888 . . . . 0.0 111.066 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.06 -21.33 66.37 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.205 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -62.0 -42.72 99.46 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.526 1.057 . . . . 0.0 110.0 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -58.86 -50.3 79.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 123.45 0.7 . . . . 0.0 109.207 175.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 32.2 tp60 -70.36 -24.76 63.02 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.924 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.42 -42.86 92.83 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.406 1.003 . . . . 0.0 110.252 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 74.5 mt -66.95 -47.15 83.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.462 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 93.2 mttt -60.72 -37.78 82.88 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.012 -177.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.53 -46.94 88.32 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 119.003 0.82 . . . . 0.0 111.301 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 46.2 m -68.48 -29.85 68.56 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.578 -0.701 . . . . 0.0 111.405 174.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 37.8 m -62.76 -39.78 95.22 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.279 0.491 . . . . 0.0 110.172 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 89.9 mt -67.28 -48.63 77.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 119.008 0.822 . . . . 0.0 109.319 173.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -68.56 -33.78 74.68 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -169.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -147.19 -44.96 0.17 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.468 0.707 . . . . 0.0 111.859 -168.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 140.83 177.52 16.27 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 119.107 -0.83 . . . . 0.0 111.333 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -37.11 127.54 0.55 Allowed 'Trans proline' 0 N--CA 1.458 -0.596 1 C-N-CA 125.586 4.191 . . . . 0.0 114.674 176.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -51.72 -40.62 60.51 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.233 1.013 . . . . 0.0 113.248 174.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -144.4 134.67 24.34 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-N 118.987 0.812 . . . . 0.0 109.892 -177.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.1 mm -140.4 138.48 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 177.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -123.27 -32.24 3.45 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.294 0.638 . . . . 0.0 111.692 -169.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.03 158.97 24.73 Favored Pre-proline 0 C--O 1.237 0.433 0 C-N-CA 126.927 2.091 . . . . 0.0 105.627 -175.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -60.0 117.04 3.74 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 121.505 1.47 . . . . 0.0 109.541 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 94.48 6.33 61.19 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.349 -1.25 . . . . 0.0 113.641 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.0 t -130.62 122.5 52.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 119.477 1.639 . . . . 0.0 108.197 -171.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.9 167.52 14.55 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.575 1.55 . . . . 0.0 109.461 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 12.8 ttm -143.38 66.81 16.23 Favored Pre-proline 0 C--N 1.331 -0.219 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -58.69 147.51 87.28 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 CA-C-O 122.472 0.947 . . . . 0.0 111.511 -173.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -179.54 155.02 0.65 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 128.365 2.666 . . . . 0.0 105.444 -169.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -133.9 153.74 51.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 169.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -54.45 145.14 39.49 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-O 117.685 -1.15 . . . . 0.0 109.377 -177.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -44.46 -44.91 13.21 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 123.818 3.012 . . . . 0.0 113.204 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.0 -14.51 48.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.617 1.567 . . . . 0.0 113.151 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 65.3 m -73.64 -25.24 60.19 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 118.613 0.642 . . . . 0.0 110.771 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 150.97 17.35 0.07 OUTLIER Glycine 0 C--N 1.337 0.609 0 CA-C-O 118.295 -1.28 . . . . 0.0 114.154 -178.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.22 152.54 44.94 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.142 1.471 . . . . 0.0 109.372 169.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.2 mt -131.65 -31.86 1.53 Allowed 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 124.128 0.971 . . . . 0.0 110.724 -175.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 75.3 mttt -146.68 158.24 43.87 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 125.628 1.571 . . . . 0.0 108.496 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.3 m -92.15 122.84 35.03 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.086 0.554 . . . . 0.0 110.184 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.07 -176.15 38.92 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.697 1.141 . . . . 0.0 111.02 -177.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 51.7 mtt -145.85 172.31 13.52 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.397 1.479 . . . . 0.0 110.64 -176.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 70.2 m -149.5 160.41 43.49 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.802 1.241 . . . . 0.0 109.06 169.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.4 tp -136.47 121.27 18.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.177 1.791 . . . . 0.0 108.892 -172.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 91.5 m -137.63 129.76 29.09 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -171.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.2 tp -122.89 139.1 54.4 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.8 mp -119.84 118.81 31.77 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 126.559 1.944 . . . . 0.0 106.433 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -60.12 -24.5 64.73 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.769 0.827 . . . . 0.0 113.007 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -115.58 -9.28 12.04 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.63 1.172 . . . . 0.0 111.946 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 61.17 -176.98 4.51 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 123.734 0.683 . . . . 0.0 112.119 -169.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -149.6 160.62 5.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 169.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -105.32 108.33 19.78 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.519 0.676 . . . . 0.0 110.96 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -74.9 135.28 74.24 Favored Pre-proline 0 N--CA 1.448 -0.532 0 C-N-CA 124.572 1.149 . . . . 0.0 108.396 170.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -66.28 156.87 62.92 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.492 2.128 . . . . 0.0 110.474 176.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 70.65 24.4 76.93 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-O 119.602 -0.554 . . . . 0.0 113.451 173.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 42.5 t30 -136.86 164.72 27.64 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.292 1.437 . . . . 0.0 107.747 171.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -78.94 -25.44 43.62 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -172.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -147.33 164.74 21.5 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.214 0.606 . . . . 0.0 112.512 -169.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.2 144.62 26.65 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.12 2.547 . . . . 0.0 111.031 177.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 22.1 mm -87.13 131.9 33.87 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt -103.88 -25.76 12.93 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.97 169.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -134.06 132.27 39.81 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 120.655 1.57 . . . . 0.0 109.966 -174.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -131.24 126.76 36.33 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -174.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.0 mt -109.84 103.59 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 169.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -66.6 146.8 49.05 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 169.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -143.0 138.07 29.76 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 104.907 -2.257 . . . . 0.0 104.907 169.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 94.9 p -131.34 147.95 52.62 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 126.139 1.775 . . . . 0.0 106.762 168.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -147.33 135.35 21.37 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.26 -21.52 58.5 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.753 0.421 . . . . 0.0 111.81 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -144.66 155.8 43.78 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.02 0.928 . . . . 0.0 109.825 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.18 -35.42 75.34 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.0 -31.05 62.78 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 120.894 -1.128 . . . . 0.0 111.064 176.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.8 m -64.8 -38.34 90.64 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.926 -0.484 . . . . 0.0 110.33 170.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -59.31 -49.72 76.76 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 123.521 0.729 . . . . 0.0 109.662 171.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.2 mm -55.37 -52.61 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.03 -39.72 96.07 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-N 119.098 0.863 . . . . 0.0 112.093 -177.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.85 -52.82 32.36 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.291 1.036 . . . . 0.0 110.635 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.9 mm -51.8 -47.86 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 C-N-CA 125.414 1.485 . . . . 0.0 108.571 174.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -67.45 -9.96 46.94 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 120.931 -1.106 . . . . 0.0 112.31 -177.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -91.46 -49.95 6.05 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 169.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.77 -22.84 62.34 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -173.456 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 33.7 m -62.95 -25.68 68.47 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.673 0.789 . . . . 0.0 111.135 172.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -66.75 -22.89 66.04 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.582 -0.699 . . . . 0.0 109.427 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 32.1 mt -95.04 -71.92 0.65 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.208 1.003 . . . . 0.0 110.621 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 22.5 mt -68.57 -16.47 63.87 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -169.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 32.1 m -97.28 27.75 4.02 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 120.176 1.353 . . . . 0.0 111.423 177.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -132.4 112.86 12.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.209 1.804 . . . . 0.0 106.388 173.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -61.89 -26.21 68.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.981 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -64.15 -42.87 96.59 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.006 0.523 . . . . 0.0 109.99 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.93 -43.21 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 123.689 0.796 . . . . 0.0 109.146 175.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 46.4 mt -55.02 -42.27 72.39 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 118.934 0.788 . . . . 0.0 111.095 -176.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -69.12 -36.5 77.56 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 118.579 -0.724 . . . . 0.0 111.015 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -65.21 -40.25 93.89 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 119.627 1.103 . . . . 0.0 108.951 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 24.6 mt -66.95 -52.6 40.97 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 176.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 54.9 mt -63.61 -9.0 11.42 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 61.1 p -122.7 10.48 9.66 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.688 1.195 . . . . 0.0 111.356 176.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.93 113.22 2.67 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 124.289 1.036 . . . . 0.0 109.72 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.5 m -74.63 -15.38 60.82 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.864 0.866 . . . . 0.0 112.212 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 85.8 p -153.05 163.09 40.48 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.894 0.854 . . . . 0.0 111.599 -173.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -58.04 -37.61 74.72 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.883 1.273 . . . . 0.0 109.494 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -60.67 -41.41 95.02 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 123.102 0.561 . . . . 0.0 110.945 175.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -65.38 -36.32 83.64 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 118.752 0.706 . . . . 0.0 112.138 176.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 36.4 mt -65.28 -46.93 78.47 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.641 1.11 . . . . 0.0 108.69 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.66 -32.97 67.83 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.921 0.888 . . . . 0.0 113.203 172.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -67.58 -40.52 84.84 Favored 'General case' 0 C--N 1.33 -0.243 0 O-C-N 121.103 -0.998 . . . . 0.0 110.412 177.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 71.1 mt -66.52 -36.76 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 123.777 0.831 . . . . 0.0 109.427 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.0 mm -58.61 -52.11 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 169.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 22.7 m -63.88 -27.78 69.39 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.259 0.224 . . . . 0.0 111.415 -173.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -60.09 -26.31 66.09 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.399 1.48 . . . . 0.0 113.104 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.867 0 N-CA-C 108.662 -1.775 . . . . 0.0 108.662 -178.643 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 tpp . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.4 mmm-85 -65.53 117.23 7.71 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 169.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.27 -44.92 94.91 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 177.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.3 p -56.36 -19.75 16.09 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.295 1.038 . . . . 0.0 113.187 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.25 -26.6 68.86 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.738 1.153 . . . . 0.0 112.338 174.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -96.87 -23.41 16.37 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 118.241 -0.885 . . . . 0.0 112.852 -172.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -101.81 101.55 18.76 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 120.298 1.408 . . . . 0.0 107.331 -173.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.55 -64.44 0.08 OUTLIER 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.378 2.719 . . . . 0.0 115.164 -169.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.482 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.9 tp10 -158.94 -77.68 0.07 Allowed 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.74 0.816 . . . . 0.0 111.908 -172.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.23 10.86 0.27 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.089 1.355 . . . . 0.0 111.502 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.482 ' H ' ' C ' ' A' ' 9' ' ' GLU . 1.8 p -79.27 12.09 2.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.149 2.18 . . . . 0.0 113.329 -169.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 mp -135.24 130.11 50.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 173.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.6 m -144.35 153.76 42.31 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.034 0.534 . . . . 0.0 110.866 175.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 74.1 t -122.81 142.23 40.14 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 106.182 -1.784 . . . . 0.0 106.182 170.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.4 mt -140.59 146.11 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 -170.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 48.8 m-70 -65.42 -51.94 56.8 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 174.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -159.0 147.63 18.3 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.06 149.84 37.42 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 171.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 tmmm? -58.2 -39.22 78.39 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.029 0.532 . . . . 0.0 109.788 177.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -161.67 175.93 11.5 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 126.465 1.906 . . . . 0.0 107.937 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -69.16 -33.69 73.8 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 123.364 0.665 . . . . 0.0 111.552 174.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -61.18 -41.82 97.48 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 119.858 1.208 . . . . 0.0 108.884 169.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -67.44 -32.89 74.06 Favored 'General case' 0 C--O 1.223 -0.319 0 O-C-N 121.606 -0.684 . . . . 0.0 111.561 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -34.83 78.94 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.946 0.498 . . . . 0.0 110.005 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.34 -46.79 80.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 169.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -55.12 -47.23 75.33 Favored 'General case' 0 C--O 1.226 -0.171 0 C-N-CA 122.954 0.501 . . . . 0.0 110.047 -176.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -66.28 -31.37 72.13 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.441 174.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.8 m -61.87 -22.49 65.58 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.918 1.235 . . . . 0.0 112.032 172.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.2 mmt -123.06 -17.51 6.67 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -169.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.34 -36.51 52.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 120.619 1.554 . . . . 0.0 113.019 -169.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.6 m -67.31 -31.76 72.27 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.989 0.813 . . . . 0.0 110.932 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 73.3 mt -73.49 -40.95 63.7 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.748 0.819 . . . . 0.0 109.106 173.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.0 tp -59.34 -44.61 92.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.455 0.702 . . . . 0.0 110.495 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -64.25 -42.51 96.48 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 124.222 1.009 . . . . 0.0 111.693 -176.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.3 13.7 3.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.98 1.312 . . . . 0.0 111.735 175.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.301 6.2 p30 44.51 37.47 2.13 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.68 1.992 . . . . 0.0 114.944 -176.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -69.9 -18.94 63.42 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.088 -1.008 . . . . 0.0 109.492 168.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.7 pt -145.86 168.33 7.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 126.736 2.014 . . . . 0.0 108.766 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 m -106.13 162.02 14.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.775 1.63 . . . . 0.0 108.695 169.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -58.78 -36.88 75.15 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.172 -0.955 . . . . 0.0 112.28 -174.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -59.99 -24.08 64.16 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.893 0.877 . . . . 0.0 113.007 175.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -63.74 -46.16 86.59 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 119.485 1.039 . . . . 0.0 110.264 175.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.5 -47.92 90.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -66.94 -27.66 67.65 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 118.473 -0.775 . . . . 0.0 111.774 -175.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.35 74.33 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.323 0.965 . . . . 0.0 111.691 173.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 26.1 mt -76.12 -50.59 22.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -57.89 -44.68 86.86 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 -173.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.9 -50.69 71.2 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.377 0.671 . . . . 0.0 111.071 -172.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.5 m -66.2 -38.74 88.72 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 118.051 0.387 . . . . 0.0 110.744 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.1 m -56.25 -46.45 79.62 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.137 0.575 . . . . 0.0 111.012 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 73.5 mt -71.07 -42.22 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 123.243 0.617 . . . . 0.0 109.979 -178.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -77.88 -33.66 51.91 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -169.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -23.25 1.65 Allowed 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -169.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.64 161.17 10.91 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 125.109 1.338 . . . . 0.0 110.18 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -64.04 153.33 76.65 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.219 1.946 . . . . 0.0 110.126 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -131.73 14.46 4.87 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -171.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -139.01 80.96 1.82 Allowed 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 125.073 1.349 . . . . 0.0 107.989 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.5 mm -124.29 136.64 59.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -122.25 -30.38 4.01 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.304 0.642 . . . . 0.0 111.666 -169.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.59 160.91 27.73 Favored Pre-proline 0 C--O 1.236 0.351 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -57.08 113.51 1.51 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 121.857 1.704 . . . . 0.0 108.959 169.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.22 -8.94 49.52 Favored Glycine 0 CA--C 1.531 1.088 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.187 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.2 t -129.48 125.1 61.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 CA-C-N 119.943 1.871 . . . . 0.0 109.831 -169.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -123.68 167.99 13.25 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 125.687 1.595 . . . . 0.0 109.684 175.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 ttm -141.86 62.27 14.22 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -49.58 142.3 24.41 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.417 2.078 . . . . 0.0 114.421 -175.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 179.93 153.7 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 128.754 2.822 . . . . 0.0 106.256 -171.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.92 159.26 42.01 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 125.741 1.616 . . . . 0.0 107.609 169.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 32.1 mtp-105 -51.16 142.66 18.37 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-O 117.707 -1.139 . . . . 0.0 109.203 177.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_exo -45.53 -42.02 18.38 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.716 2.944 . . . . 0.0 113.091 -178.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -61.31 -14.48 27.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.429 1.492 . . . . 0.0 113.336 -177.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.9 m -77.76 -9.27 58.92 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.588 0.755 . . . . 0.0 112.011 -178.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 137.12 17.28 0.71 Allowed Glycine 0 CA--C 1.527 0.82 0 CA-C-O 118.195 -1.336 . . . . 0.0 113.868 178.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.97 149.38 47.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.801 1.8 . . . . 0.0 109.463 169.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.2 mt -129.43 -35.86 1.72 Allowed 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.781 1.233 . . . . 0.0 110.146 -176.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -144.76 158.93 43.6 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.502 1.521 . . . . 0.0 108.49 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 76.1 m -90.97 127.25 36.34 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.147 0.579 . . . . 0.0 110.367 -178.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -170.98 -178.69 41.7 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.978 1.275 . . . . 0.0 110.836 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 37.9 mtt -145.44 170.36 16.53 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.675 1.59 . . . . 0.0 110.713 -177.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.8 m -152.79 171.5 18.16 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.355 1.462 . . . . 0.0 109.245 169.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.9 tp -143.81 128.86 18.6 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 127.052 2.141 . . . . 0.0 107.895 -169.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 90.5 m -130.46 143.14 50.57 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.057 1.343 . . . . 0.0 107.554 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.2 tp -134.17 143.33 47.83 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 171.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -113.3 137.73 51.06 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.591 1.156 . . . . 0.0 108.724 176.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -69.36 -40.98 77.15 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 168.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -118.92 96.35 5.21 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.964 2.106 . . . . 0.0 107.996 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -50.85 156.96 2.51 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.002 1.286 . . . . 0.0 112.942 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.1 t -118.84 152.78 21.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -113.85 93.95 4.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.899 0.879 . . . . 0.0 110.458 -167.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -47.25 135.45 9.16 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.078 169.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -61.5 133.47 45.98 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 121.805 1.67 . . . . 0.0 110.393 -175.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 71.44 7.95 65.37 Favored Glycine 0 CA--C 1.533 1.203 0 CA-C-O 118.458 -1.19 . . . . 0.0 114.444 176.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -71.98 173.45 8.37 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.85 1.825 . . . . 0.0 111.131 174.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -65.55 -45.94 81.44 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 122.098 -0.376 . . . . 0.0 111.176 173.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -159.99 173.71 4.63 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 125.588 1.555 . . . . 0.0 112.344 -176.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -57.21 154.68 33.03 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.185 2.59 . . . . 0.0 113.391 173.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 39.9 mm -111.42 132.83 58.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -105.44 -15.4 15.03 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 117.347 -1.311 . . . . 0.0 110.973 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 46.4 tp -140.21 131.08 25.99 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 120.279 1.4 . . . . 0.0 109.979 -169.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.8 mp -137.53 138.87 40.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -176.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 3.7 mt -118.03 119.88 62.81 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 169.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.21 148.47 32.88 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.964 -1.654 . . . . 0.0 108.964 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -143.13 136.79 28.59 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 104.402 -2.444 . . . . 0.0 104.402 169.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.0 p -129.95 147.48 51.71 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 106.43 -1.692 . . . . 0.0 106.43 169.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.3 136.35 23.56 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 118.911 0.778 . . . . 0.0 109.244 -176.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.19 -22.63 55.1 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.804 0.442 . . . . 0.0 111.87 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -145.66 155.86 43.28 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.826 0.85 . . . . 0.0 109.984 -178.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.18 -34.97 74.33 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -75.09 -31.92 61.33 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 120.84 -1.162 . . . . 0.0 111.01 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.5 m -63.55 -40.59 97.39 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 122.095 -0.378 . . . . 0.0 110.025 169.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -58.28 -48.75 79.49 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.753 0.821 . . . . 0.0 110.104 172.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 11.1 mm -56.21 -53.63 37.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 123.472 0.709 . . . . 0.0 109.345 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.9 -39.05 96.39 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 118.822 0.737 . . . . 0.0 111.691 -176.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.61 -52.51 44.45 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.343 1.057 . . . . 0.0 110.451 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.5 mm -53.05 -47.32 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 C-N-CA 125.322 1.449 . . . . 0.0 108.791 176.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -66.96 -16.29 64.25 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.735 -0.603 . . . . 0.0 111.858 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -87.48 -46.38 9.65 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.695 0.798 . . . . 0.0 109.534 174.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.9 pp -71.17 -23.95 62.15 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.171 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 63.0 m -59.5 -23.4 62.75 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.4 0.68 . . . . 0.0 112.11 172.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -64.62 -20.92 66.56 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.164 0.893 . . . . 0.0 110.25 173.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 31.0 mt -106.59 -60.71 1.63 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.631 1.572 . . . . 0.0 111.095 -178.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.24 -31.55 69.18 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.916 1.286 . . . . 0.0 113.622 -177.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 60.5 m -101.67 26.97 6.78 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 118.681 0.673 . . . . 0.0 110.832 -175.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -139.94 93.21 2.62 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -170.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.1 -27.0 41.83 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.949 0.9 . . . . 0.0 112.756 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.95 -45.55 91.95 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 122.882 0.473 . . . . 0.0 110.034 176.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.5 mp -68.16 -45.34 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.907 0.883 . . . . 0.0 108.817 175.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 73.0 mt -54.78 -42.69 72.06 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 118.753 -0.642 . . . . 0.0 111.291 -174.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -67.05 -40.87 87.19 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 118.407 0.549 . . . . 0.0 110.601 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.19 -33.99 74.23 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 118.71 0.687 . . . . 0.0 110.124 -176.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 23.4 mt -69.74 -53.37 18.72 Favored 'General case' 0 C--O 1.224 -0.239 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 170.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 31.4 mt -57.41 -21.05 33.92 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -176.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 82.6 p -114.21 8.53 16.88 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.539 1.136 . . . . 0.0 111.181 -177.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.92 125.32 22.56 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.206 1.002 . . . . 0.0 110.244 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.9 m -85.27 -10.1 56.9 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.119 0.968 . . . . 0.0 111.683 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 71.9 p -154.4 159.19 40.97 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.903 0.774 . . . . 0.0 110.451 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -59.16 -33.51 71.01 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.175 0.59 . . . . 0.0 109.644 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -57.75 -39.27 76.96 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 118.967 -0.539 . . . . 0.0 111.236 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -66.32 -44.4 83.48 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.806 0.73 . . . . 0.0 111.671 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.02 -50.28 71.3 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.769 0.713 . . . . 0.0 109.135 178.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.01 -32.6 66.31 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.912 1.285 . . . . 0.0 113.381 173.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.12 -43.26 82.87 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 119.877 1.217 . . . . 0.0 110.054 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 88.9 mt -64.91 -36.43 77.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 123.732 0.813 . . . . 0.0 109.587 178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 29.8 mm -58.51 -52.28 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 33.8 m -66.77 -26.41 66.95 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.754 0.422 . . . . 0.0 111.385 -171.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -57.69 -28.85 64.18 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.868 1.667 . . . . 0.0 113.001 173.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.933 0 N-CA-C 109.002 -1.639 . . . . 0.0 109.002 -174.765 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 tpt . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -66.79 109.21 2.8 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 169.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -52.24 -42.08 63.32 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.211 0.604 . . . . 0.0 110.05 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.61 -22.47 13.55 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.853 1.661 . . . . 0.0 113.485 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -65.71 -26.85 67.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.153 0.888 . . . . 0.0 112.094 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -96.71 -19.08 19.23 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.189 -170.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -97.7 112.72 62.22 Favored Pre-proline 0 CA--C 1.546 0.809 0 CA-C-N 120.864 1.665 . . . . 0.0 108.75 -173.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.69 -173.22 0.09 OUTLIER 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 125.236 3.957 . . . . 0.0 114.711 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -72.99 145.61 46.58 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 171.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.1 m 50.08 24.36 1.38 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.359 1.464 . . . . 0.0 112.428 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 p -74.49 -9.04 58.2 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.444 -0.785 . . . . 0.0 112.357 -172.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.4 mp -115.49 136.94 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 C-N-CA 126.634 1.973 . . . . 0.0 107.048 -170.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.7 m -144.76 156.22 43.94 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.714 1.206 . . . . 0.0 110.335 -177.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.6 t -129.66 144.55 37.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 174.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mt -143.29 150.09 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 126.294 1.838 . . . . 0.0 106.539 -170.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -74.93 -48.2 25.8 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.565 -0.709 . . . . 0.0 109.883 171.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -159.95 144.19 14.6 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.184 -1.413 . . . . 0.0 107.184 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.17 162.12 24.87 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 169.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.3 tppt? -59.37 -43.75 92.83 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.033 0.533 . . . . 0.0 110.554 178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -167.17 -178.1 3.98 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 127.679 2.392 . . . . 0.0 107.758 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.5 p-90 -64.3 -32.7 74.41 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.463 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.4 mt-30 -59.31 -52.7 64.52 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.706 1.594 . . . . 0.0 107.381 172.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -60.05 -36.55 77.56 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 121.803 -0.56 . . . . 0.0 111.295 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.61 -30.14 71.16 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 118.833 -0.603 . . . . 0.0 111.09 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -69.09 -47.7 73.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 119.292 0.951 . . . . 0.0 108.548 172.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -55.68 -47.74 76.26 Favored 'General case' 0 C--O 1.227 -0.098 0 CA-C-N 118.315 0.507 . . . . 0.0 109.883 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -61.41 -33.59 73.96 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 117.928 -1.034 . . . . 0.0 111.974 174.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.1 m -64.83 -29.97 70.95 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 119.987 1.267 . . . . 0.0 112.428 175.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.6 mmm -115.95 -13.98 11.27 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -168.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -58.58 -33.85 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 120.299 1.409 . . . . 0.0 112.514 -169.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.7 p -65.78 -37.62 86.8 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.327 0.967 . . . . 0.0 110.652 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 77.7 mt -72.17 -37.81 69.26 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.587 0.755 . . . . 0.0 109.268 175.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.47 -44.23 96.1 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.685 0.675 . . . . 0.0 110.306 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -63.89 -45.09 90.91 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.878 1.271 . . . . 0.0 111.827 -176.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -80.44 12.52 2.96 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.282 1.033 . . . . 0.0 111.595 175.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.33 4.6 p30 43.54 43.21 4.46 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.821 2.049 . . . . 0.0 114.891 -176.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -75.96 -17.15 59.84 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 167.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.5 pt -145.26 173.82 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.653 1.981 . . . . 0.0 109.271 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.6 m -114.66 163.03 16.0 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.164 1.786 . . . . 0.0 109.267 169.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.21 -32.82 72.59 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.308 -0.87 . . . . 0.0 113.047 -170.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -58.23 -30.89 66.87 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.83 -0.544 . . . . 0.0 111.729 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -59.06 -46.59 87.86 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.391 0.676 . . . . 0.0 110.38 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.8 mp -56.73 -48.37 81.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 123.612 0.765 . . . . 0.0 109.001 176.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.5 tp60 -69.29 -26.24 64.64 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.264 -0.874 . . . . 0.0 112.027 -176.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.2 -39.37 93.84 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.828 1.195 . . . . 0.0 111.508 173.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 53.3 mt -66.5 -46.42 86.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.463 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.5 mttt -62.09 -42.4 99.18 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -178.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.18 -38.61 91.68 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 124.009 0.924 . . . . 0.0 111.407 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 m -62.93 -40.54 97.92 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.815 -0.553 . . . . 0.0 110.187 172.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 26.1 m -61.44 -38.52 87.47 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.762 0.825 . . . . 0.0 111.17 174.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.5 mt -64.42 -44.9 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 119.92 1.236 . . . . 0.0 109.817 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -65.23 -37.71 88.11 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -169.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -142.53 -9.56 0.83 Allowed 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 -168.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.48 178.42 32.61 Favored Glycine 0 CA--C 1.532 1.114 0 N-CA-C 107.711 -2.156 . . . . 0.0 107.711 -168.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -59.72 140.35 93.02 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 121.782 1.655 . . . . 0.0 109.384 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -126.48 10.46 7.29 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -134.78 88.1 2.4 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 169.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.4 mm -135.67 131.96 50.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 -173.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -124.55 -24.41 4.21 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 123.805 0.691 . . . . 0.0 110.918 -172.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.53 165.28 19.07 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 124.689 1.196 . . . . 0.0 108.112 170.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -49.35 126.94 16.79 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.338 2.025 . . . . 0.0 110.062 169.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.39 1.82 77.19 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-O 117.88 -1.511 . . . . 0.0 115.48 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 77.8 t -131.01 117.31 37.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-N 120.322 2.061 . . . . 0.0 108.355 -173.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.17 163.57 16.87 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.687 1.595 . . . . 0.0 109.917 -177.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.7 ttm -134.14 60.68 46.1 Favored Pre-proline 0 CA--C 1.545 0.751 0 CA-C-O 118.998 -0.525 . . . . 0.0 112.096 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -54.06 147.82 42.03 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.345 2.03 . . . . 0.0 113.293 -172.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 175.6 157.52 0.21 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 128.726 2.811 . . . . 0.0 106.542 -168.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.39 159.12 42.85 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 126.137 1.775 . . . . 0.0 107.931 169.399 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -51.21 143.34 17.52 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-O 118.3 -0.857 . . . . 0.0 109.322 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -47.91 -42.07 31.81 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.079 2.519 . . . . 0.0 113.017 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -62.22 -13.34 26.9 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.873 1.269 . . . . 0.0 114.05 -177.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 72.2 m -77.39 -6.12 52.21 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.636 0.774 . . . . 0.0 111.897 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 132.91 18.03 1.12 Allowed Glycine 0 CA--C 1.524 0.655 0 CA-C-O 118.206 -1.33 . . . . 0.0 113.315 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.45 148.13 49.99 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.792 1.796 . . . . 0.0 108.986 169.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.6 mt -127.66 -35.19 2.14 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 124.827 1.251 . . . . 0.0 110.501 -175.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.8 mttp -142.4 158.83 43.28 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 125.707 1.603 . . . . 0.0 107.916 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.1 m -91.15 125.17 35.85 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 123.157 0.583 . . . . 0.0 109.709 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -171.94 179.79 43.38 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.672 1.13 . . . . 0.0 110.966 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 56.7 mtt -143.23 167.95 20.92 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 125.453 1.501 . . . . 0.0 110.154 -172.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.4 p -148.57 167.53 25.16 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.926 1.291 . . . . 0.0 108.346 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 5.1 tp -142.75 124.71 15.22 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.609 -0.682 . . . . 0.0 109.77 -176.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 64.9 m -131.77 133.49 44.81 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.5 tp -126.44 139.11 53.5 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 173.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.3 mp -119.31 123.27 43.81 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 105.296 -2.112 . . . . 0.0 105.296 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.1 -41.26 92.18 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.666 0.667 . . . . 0.0 111.532 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 -90.69 -16.7 28.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.383 1.073 . . . . 0.0 111.724 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.21 178.86 9.1 Favored Glycine 0 CA--C 1.534 1.272 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -168.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.07 156.88 15.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 168.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -102.87 99.29 9.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.908 0.861 . . . . 0.0 112.189 -168.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -67.29 142.24 96.6 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 114.332 -1.304 . . . . 0.0 108.484 169.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -75.49 69.02 6.03 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 124.082 3.188 . . . . 0.0 113.241 -169.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 165.3 -11.3 0.07 OUTLIER Glycine 0 CA--C 1.531 1.088 0 CA-C-O 118.336 -1.258 . . . . 0.0 116.015 169.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -70.36 169.57 13.63 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.776 1.788 . . . . 0.0 110.48 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -69.12 -32.42 71.8 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.45 -0.782 . . . . 0.0 111.705 170.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.87 168.73 10.42 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 124.546 1.138 . . . . 0.0 112.153 -175.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -51.26 131.25 35.25 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.368 2.712 . . . . 0.0 112.116 174.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 27.9 mm -69.47 111.41 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 175.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -82.94 -29.53 29.05 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 116.743 -1.599 . . . . 0.0 110.409 169.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.8 tp -132.68 139.94 47.9 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 121.174 1.806 . . . . 0.0 112.126 -173.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.0 mp -134.6 103.27 5.6 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -178.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -83.17 118.1 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.142 0 N-CA-C 104.442 -2.429 . . . . 0.0 104.442 169.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.35 150.81 26.23 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 172.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -142.9 142.86 31.83 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 169.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 16.3 m -142.85 143.52 32.13 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 169.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.46 139.08 29.7 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 -169.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.39 -23.26 43.39 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.153 0.581 . . . . 0.0 111.92 -176.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -145.48 156.63 43.85 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.172 0.989 . . . . 0.0 109.809 -178.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.77 -34.75 73.4 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.178 0.806 . . . . 0.0 113.178 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -75.78 -32.34 59.86 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 120.936 -1.103 . . . . 0.0 111.062 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.2 m -62.32 -42.01 99.01 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 169.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 35.5 t60 -57.92 -49.09 77.94 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.034 0.933 . . . . 0.0 110.211 173.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 8.9 mm -56.21 -54.77 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 118.869 0.759 . . . . 0.0 109.444 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.24 -38.48 94.61 Favored Glycine 0 CA--C 1.531 1.035 0 CA-C-N 118.664 0.666 . . . . 0.0 111.71 -176.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.78 -49.48 58.31 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.493 1.117 . . . . 0.0 110.816 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.9 mm -55.94 -43.05 73.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 124.448 1.099 . . . . 0.0 108.989 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.3 mm-40 -70.49 -12.88 61.86 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.461 0.704 . . . . 0.0 112.061 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.26 -43.67 14.62 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 170.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.3 mt -70.06 -27.71 64.86 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 121.864 -0.523 . . . . 0.0 111.759 -176.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 27.9 m -57.65 -21.87 42.39 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 171.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -74.89 -22.46 58.63 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.556 1.071 . . . . 0.0 111.058 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 49.2 mt -101.98 -62.22 1.29 Allowed 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 123.872 0.869 . . . . 0.0 110.639 -177.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.37 -13.24 58.16 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.402 1.481 . . . . 0.0 113.62 -173.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 37.3 m -117.81 29.86 7.59 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.039 0.836 . . . . 0.0 110.511 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -131.98 107.99 9.05 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 123.841 0.856 . . . . 0.0 109.035 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -55.96 -34.58 65.83 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.721 1.208 . . . . 0.0 110.454 -176.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -61.79 -44.84 96.08 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.242 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.35 -44.05 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 124.372 1.069 . . . . 0.0 109.351 177.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 7.0 mp -50.52 -45.24 56.56 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 119.123 0.874 . . . . 0.0 111.506 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -68.73 -37.09 79.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.829 0.74 . . . . 0.0 110.698 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -64.69 -40.49 95.48 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 118.969 0.804 . . . . 0.0 108.913 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.3 mt -69.12 -53.38 20.5 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.0 mt -61.44 -11.85 12.23 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.232 1.013 . . . . 0.0 113.575 -174.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 70.8 p -121.87 5.83 9.91 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.593 1.157 . . . . 0.0 111.661 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.63 119.58 7.86 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 124.58 1.152 . . . . 0.0 110.539 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -76.59 -15.6 59.8 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.186 0.994 . . . . 0.0 112.345 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.4 p -153.41 163.44 39.92 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 119.077 0.853 . . . . 0.0 111.502 -172.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 51.6 mp0 -59.09 -35.86 74.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.011 0.924 . . . . 0.0 109.18 169.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -59.15 -47.08 86.62 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 122.855 0.462 . . . . 0.0 110.96 175.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.57 -34.14 77.56 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.4 mt -66.34 -46.38 77.0 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.398 0.999 . . . . 0.0 109.276 174.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.11 -31.99 73.26 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.423 0.689 . . . . 0.0 112.445 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -58.59 -36.51 74.09 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.914 -1.116 . . . . 0.0 110.987 175.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 68.2 mt -71.74 -36.47 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 C-N-CA 124.083 0.953 . . . . 0.0 109.932 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 50.7 mm -52.88 -52.5 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 24.8 m -69.23 -29.15 67.03 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.215 -171.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.0 ttm105 -70.07 -37.11 75.39 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 125.375 1.47 . . . . 0.0 110.628 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.166 -1.352 . . . . 0.0 111.229 177.971 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpp? . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -68.06 112.38 5.0 Favored 'General case' 0 C--N 1.341 0.225 0 N-CA-C 104.281 -2.488 . . . . 0.0 104.281 168.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -53.41 -39.01 63.98 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.321 0.648 . . . . 0.0 110.368 -175.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.7 p -53.4 -19.74 3.82 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.972 1.709 . . . . 0.0 114.066 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -60.86 -23.45 65.15 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.924 1.238 . . . . 0.0 112.706 175.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.61 -14.71 15.53 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -170.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -102.27 109.58 60.63 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 120.465 1.484 . . . . 0.0 108.079 -173.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -62.05 -70.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.042 2.495 . . . . 0.0 113.664 -173.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.434 ' C ' ' H ' ' A' ' 11' ' ' SER . 34.5 tt0 -163.15 -71.9 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.936 0.894 . . . . 0.0 111.637 -174.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 m -69.86 6.4 1.21 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.69 1.196 . . . . 0.0 111.912 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.434 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER -71.31 -6.12 37.55 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.856 1.662 . . . . 0.0 113.593 -169.522 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.8 mt -122.75 130.14 74.69 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.787 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 -169.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.9 p -155.71 151.06 26.9 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.642 0.734 . . . . 0.0 111.914 -176.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.9 t -121.14 141.29 42.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 170.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.6 mt -136.58 145.99 29.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 C-N-CA 125.142 1.377 . . . . 0.0 108.214 -169.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -71.36 -38.43 71.58 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.807 -0.558 . . . . 0.0 111.699 175.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.9 p -174.33 148.15 1.23 Allowed 'General case' 0 C--O 1.237 0.403 0 N-CA-C 105.393 -2.077 . . . . 0.0 105.393 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.12 150.45 35.61 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 170.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.71 -41.55 81.98 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 176.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -157.61 169.65 24.19 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 126.78 2.032 . . . . 0.0 106.667 171.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -34.7 59.91 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.322 1.449 . . . . 0.0 112.718 169.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.43 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 26.2 mt-30 -60.64 -48.44 81.76 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.68 1.127 . . . . 0.0 109.383 170.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -63.5 -32.29 73.7 Favored 'General case' 0 C--O 1.223 -0.34 0 O-C-N 121.771 -0.581 . . . . 0.0 111.263 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.1 -36.29 83.09 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 121.833 -0.542 . . . . 0.0 110.059 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.99 -46.63 78.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 172.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -54.87 -45.85 74.67 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 121.751 -0.593 . . . . 0.0 110.697 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -65.32 -31.83 73.16 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 118.299 -0.858 . . . . 0.0 112.034 174.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.2 m -65.21 -20.3 66.37 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.618 1.099 . . . . 0.0 112.348 172.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.6 mmt -125.91 -20.02 4.7 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 114.919 1.452 . . . . 0.0 114.919 -168.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -60.03 -37.07 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 CA-C-N 120.714 1.597 . . . . 0.0 111.727 -169.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.3 m -65.39 -19.28 65.88 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.694 -0.629 . . . . 0.0 112.283 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 90.5 mt -91.36 -41.57 10.83 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.761 1.225 . . . . 0.0 109.144 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.6 tp -54.93 -42.68 72.55 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.007 0.923 . . . . 0.0 110.491 176.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -66.27 -28.33 68.63 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 125.312 1.445 . . . . 0.0 113.108 -173.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -99.54 18.52 17.71 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 118.241 0.473 . . . . 0.0 110.611 174.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.304 6.3 p30 46.72 38.43 5.81 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.539 1.536 . . . . 0.0 114.395 -171.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -68.42 -22.59 64.6 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.822 -1.174 . . . . 0.0 109.557 168.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.6 pt -143.43 177.24 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 126.446 1.898 . . . . 0.0 109.047 -176.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.8 m -117.16 157.46 25.91 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.603 1.961 . . . . 0.0 108.062 175.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.35 -31.79 70.65 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.026 -1.047 . . . . 0.0 112.94 -172.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -58.21 -33.24 69.08 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.887 -0.508 . . . . 0.0 111.878 175.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -60.09 -44.47 94.78 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.459 0.704 . . . . 0.0 110.494 -176.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -58.2 -50.94 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 174.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.0 tp60 -68.89 -26.17 64.98 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.412 -0.804 . . . . 0.0 112.058 -174.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.55 -43.64 89.39 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.493 1.042 . . . . 0.0 110.508 173.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 43.1 mt -68.3 -49.22 68.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.43 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.4 mttt -57.86 -42.51 84.63 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -61.35 -51.36 69.14 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.69 0.796 . . . . 0.0 111.242 -173.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 41.4 m -64.98 -39.9 94.16 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 118.306 0.503 . . . . 0.0 110.552 176.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 88.3 m -55.74 -41.35 73.79 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.964 0.506 . . . . 0.0 111.388 176.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 78.9 mt -76.16 -49.01 26.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 118.872 0.76 . . . . 0.0 109.993 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -72.45 -32.3 66.16 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -169.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -127.36 -46.42 1.48 Allowed 'General case' 0 C--O 1.231 0.113 0 C-N-CA 123.826 0.85 . . . . 0.0 110.642 -169.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 139.61 163.42 9.5 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 108.448 -1.861 . . . . 0.0 108.448 -176.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -62.55 149.17 91.94 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 121.75 1.633 . . . . 0.0 109.149 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -131.72 10.93 4.76 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 -169.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -133.6 87.64 2.4 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 169.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 39.3 mm -136.22 136.01 49.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 104.919 -2.252 . . . . 0.0 104.919 -174.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -122.89 -30.65 3.78 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 123.215 0.606 . . . . 0.0 110.893 -170.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.57 157.94 27.08 Favored Pre-proline 0 N--CA 1.452 -0.343 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 173.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -51.99 120.02 6.56 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.026 1.818 . . . . 0.0 109.139 169.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 102.81 -15.68 55.31 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-O 117.942 -1.477 . . . . 0.0 114.117 -178.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 98.0 t -129.11 119.52 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 119.769 1.785 . . . . 0.0 109.538 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -116.49 166.85 11.61 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.689 1.596 . . . . 0.0 109.385 173.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 13.5 ttm -137.37 60.68 28.11 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.667 175.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -49.7 137.13 34.36 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 122.277 1.985 . . . . 0.0 113.98 -172.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -177.63 153.12 0.85 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 128.45 2.7 . . . . 0.0 106.706 -169.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.35 161.07 36.01 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 126.392 1.877 . . . . 0.0 107.459 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -53.63 143.14 39.68 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-O 117.651 -1.166 . . . . 0.0 108.876 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -46.83 -41.28 25.22 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.643 2.895 . . . . 0.0 113.246 -177.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -58.68 -14.72 9.17 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.601 1.56 . . . . 0.0 114.134 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 61.8 m -77.9 -4.61 47.62 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.66 0.784 . . . . 0.0 111.663 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 131.48 14.36 1.75 Allowed Glycine 0 C--N 1.337 0.597 0 CA-C-O 118.039 -1.423 . . . . 0.0 113.244 172.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.18 145.01 56.29 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 119.693 1.747 . . . . 0.0 109.289 169.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.5 mt -128.48 -34.82 2.0 Allowed 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.937 1.295 . . . . 0.0 110.291 -173.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -142.47 163.85 31.71 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 126.111 1.764 . . . . 0.0 108.026 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.1 m -97.49 130.79 44.54 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.187 0.595 . . . . 0.0 110.507 -176.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -173.74 179.48 45.09 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.742 1.163 . . . . 0.0 111.211 -176.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 56.4 mtt -144.89 167.85 21.64 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.168 1.387 . . . . 0.0 112.059 -172.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.3 m -138.33 166.16 24.91 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.076 1.75 . . . . 0.0 108.918 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 49.8 tp -147.85 85.47 1.55 Allowed 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.767 1.627 . . . . 0.0 108.025 -171.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.1 m -104.62 135.11 46.64 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.1 tp -129.58 142.62 50.71 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 173.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.6 mp -122.4 132.72 54.5 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.784 1.634 . . . . 0.0 106.795 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.0 -48.14 72.17 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 123.135 0.574 . . . . 0.0 110.237 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -90.43 -13.76 34.25 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.742 0.817 . . . . 0.0 112.317 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 64.31 -176.44 10.18 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 110.691 -0.963 . . . . 0.0 110.691 -168.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -148.53 167.8 3.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 169.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -120.3 96.6 5.21 Favored 'General case' 0 C--N 1.334 -0.079 0 O-C-N 121.643 -0.661 . . . . 0.0 110.699 -169.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -53.14 136.01 49.18 Favored Pre-proline 0 CA--C 1.538 0.487 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.626 169.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -62.12 129.79 28.41 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.057 1.838 . . . . 0.0 110.715 -173.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 70.65 9.58 65.61 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-O 118.365 -1.242 . . . . 0.0 114.562 174.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -72.42 168.83 17.63 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.901 1.851 . . . . 0.0 110.736 174.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.26 -38.1 89.27 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.03 163.29 24.45 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.545 1.538 . . . . 0.0 109.299 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.33 158.43 31.14 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.469 2.113 . . . . 0.0 112.25 173.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 36.3 mm -111.04 136.34 47.4 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -177.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -108.74 -14.42 14.6 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 117.118 -1.42 . . . . 0.0 110.988 173.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 14.1 tp -139.3 136.25 34.67 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 120.854 1.661 . . . . 0.0 110.787 -175.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.6 mp -139.1 95.5 2.95 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 -172.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.7 mp -76.69 118.7 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 106.326 -1.731 . . . . 0.0 106.326 169.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -77.95 150.11 35.41 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 170.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -146.41 139.03 25.28 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 169.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 4.0 m -142.5 144.93 33.2 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 169.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.16 138.96 25.57 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -170.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -78.9 -23.28 44.88 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.818 0.447 . . . . 0.0 111.982 -175.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -143.68 155.51 44.25 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.838 0.855 . . . . 0.0 109.825 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.93 -35.66 73.47 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.648 0.779 . . . . 0.0 113.013 -177.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -76.14 -32.32 59.05 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.059 -1.026 . . . . 0.0 111.173 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.9 m -62.31 -41.57 98.63 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 169.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -57.88 -50.03 74.7 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.229 1.011 . . . . 0.0 110.056 172.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.0 mm -56.16 -54.34 28.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 118.709 0.686 . . . . 0.0 109.412 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.41 -39.4 96.18 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-N 118.775 0.716 . . . . 0.0 111.561 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.54 -49.62 62.45 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.183 0.993 . . . . 0.0 110.819 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.5 mm -55.63 -44.01 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.548 1.139 . . . . 0.0 108.974 176.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -70.72 -12.39 61.53 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.54 0.736 . . . . 0.0 112.032 -178.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.51 -45.21 13.83 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 170.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.84 -28.64 65.85 Favored 'General case' 0 CA--C 1.515 -0.371 0 O-C-N 121.919 -0.488 . . . . 0.0 111.732 -176.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.0 m -60.91 -20.76 62.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.241 0.616 . . . . 0.0 112.33 171.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -71.6 -22.57 61.7 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.672 1.124 . . . . 0.0 110.4 174.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 45.4 mt -103.3 -64.67 1.06 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.157 0.983 . . . . 0.0 110.284 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 19.2 mt -73.46 1.21 10.29 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -170.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.0 m -121.73 27.78 7.99 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.118 0.967 . . . . 0.0 110.954 174.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -139.4 95.96 3.02 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 -170.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.2 -25.53 33.51 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.131 0.972 . . . . 0.0 112.618 -172.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -63.51 -44.18 95.05 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 123.064 0.546 . . . . 0.0 110.076 175.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.3 -40.82 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 C-N-CA 125.087 1.355 . . . . 0.0 109.887 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 6.8 mp -51.41 -43.39 61.95 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 119.712 1.142 . . . . 0.0 111.678 -178.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -69.93 -36.81 75.61 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.75 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -63.76 -41.55 97.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 119.107 0.867 . . . . 0.0 108.831 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 6.8 mt -67.17 -52.93 35.34 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 60.9 mt -62.38 -14.68 42.69 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 63.5 p -116.87 5.48 12.99 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.391 1.076 . . . . 0.0 111.83 178.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.38 115.74 3.46 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.14 0.976 . . . . 0.0 109.37 177.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.5 m -87.96 -4.79 58.78 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.206 1.002 . . . . 0.0 111.933 -177.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.6 p -152.84 163.08 40.42 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.547 0.739 . . . . 0.0 110.08 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 58.8 mp0 -58.32 -37.64 75.52 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 123.943 0.897 . . . . 0.0 109.819 169.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -58.05 -45.97 86.17 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-O 119.359 -0.353 . . . . 0.0 110.356 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -65.38 -26.55 68.05 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 118.608 -0.71 . . . . 0.0 112.905 177.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 49.5 mt -72.69 -48.29 40.19 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 120.305 1.412 . . . . 0.0 109.0 172.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.09 -26.84 69.02 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 177.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -58.73 -37.97 77.34 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.007 -1.058 . . . . 0.0 110.607 172.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 67.6 mt -74.29 -36.26 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 124.018 0.927 . . . . 0.0 109.512 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 33.3 mm -55.16 -48.93 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 169.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.2 m -67.91 -26.62 66.07 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.367 -171.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 23.7 ttm105 -79.27 -16.03 57.06 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 126.852 2.061 . . . . 0.0 111.728 177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.91 0 N-CA-C 108.688 -1.765 . . . . 0.0 108.688 174.569 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tpt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.564 0.221 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -65.47 116.9 7.23 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.15 -39.05 81.23 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.651 0.78 . . . . 0.0 110.023 175.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.9 p -59.55 -14.97 15.2 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 124.937 1.295 . . . . 0.0 112.025 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -84.0 -27.14 28.63 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 123.951 0.901 . . . . 0.0 113.404 174.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -96.95 -39.01 9.58 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 122.889 0.476 . . . . 0.0 111.393 -174.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -89.03 127.02 57.22 Favored Pre-proline 0 CA--C 1.551 0.997 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -173.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -69.44 -76.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 122.552 2.168 . . . . 0.0 113.131 -170.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.455 ' C ' ' H ' ' A' ' 11' ' ' SER . 32.1 tt0 -166.39 -62.08 0.03 OUTLIER 'General case' 0 C--O 1.231 0.107 0 C-N-CA 125.317 1.447 . . . . 0.0 109.886 -177.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.04 11.75 0.28 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.93 1.692 . . . . 0.0 112.149 175.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.455 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -68.87 -23.33 64.2 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 126.938 2.095 . . . . 0.0 111.429 -169.642 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.6 mm -98.99 139.34 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.298 0 C-N-CA 124.604 1.161 . . . . 0.0 108.016 -169.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 m -158.91 128.46 5.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 118.398 0.545 . . . . 0.0 109.857 169.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 p -96.74 142.94 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 105.613 -1.995 . . . . 0.0 105.613 168.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.41 HG22 ' H ' ' A' ' 17' ' ' SER . 21.4 mt -138.31 148.61 24.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 -169.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -65.72 -48.72 71.01 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.451 -0.781 . . . . 0.0 110.309 169.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -169.67 148.46 3.66 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 105.334 -2.099 . . . . 0.0 105.334 -178.315 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.34 153.47 42.33 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 171.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -54.49 -43.23 71.61 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.381 0.673 . . . . 0.0 110.093 173.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -163.58 177.07 9.08 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 126.938 2.095 . . . . 0.0 107.765 169.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -54.81 -36.39 64.91 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 126.285 1.834 . . . . 0.0 113.937 175.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.4 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.8 mt-30 -62.52 -49.79 73.94 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 120.328 1.422 . . . . 0.0 108.459 171.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -60.65 -31.46 70.68 Favored 'General case' 0 C--O 1.222 -0.362 0 O-C-N 122.067 -0.396 . . . . 0.0 111.833 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.57 83.17 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.473 -0.767 . . . . 0.0 110.221 -178.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.3 -45.06 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 169.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -57.4 -46.56 83.33 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 122.959 0.503 . . . . 0.0 110.163 -176.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -63.43 -36.15 82.78 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.976 1.31 . . . . 0.0 111.771 172.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.5 m -62.66 -21.38 65.67 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.636 1.107 . . . . 0.0 112.504 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.7 mmt -122.43 -18.82 6.6 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -169.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.7 p -60.88 -35.92 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 121.152 1.796 . . . . 0.0 111.74 -171.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -67.16 -21.58 65.8 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.968 0.804 . . . . 0.0 111.998 179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.8 mt -83.41 -43.97 15.31 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.166 0.986 . . . . 0.0 108.658 171.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 34.2 tp -57.19 -42.85 82.01 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.331 1.052 . . . . 0.0 111.038 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.91 -30.14 67.6 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 126.271 1.829 . . . . 0.0 113.256 -176.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -108.93 20.73 18.11 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.377 0.0 OUTLIER 42.4 38.48 1.22 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.379 2.272 . . . . 0.0 115.38 -172.533 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -66.19 -21.18 66.31 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.416 -0.802 . . . . 0.0 110.081 168.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.1 pt -149.05 175.91 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 127.074 2.15 . . . . 0.0 108.488 -173.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.5 p -113.58 166.33 11.63 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.458 1.503 . . . . 0.0 108.486 169.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.46 -28.16 69.78 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.023 -1.048 . . . . 0.0 111.327 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -61.49 -38.08 86.0 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 121.679 -0.638 . . . . 0.0 111.301 176.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -57.11 -48.0 79.7 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.607 0.763 . . . . 0.0 109.85 178.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.0 mt -59.04 -50.39 79.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 124.99 1.316 . . . . 0.0 109.04 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -68.05 -27.34 66.43 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.954 -174.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.96 -43.38 86.42 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.4 1.0 . . . . 0.0 110.651 172.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 18.3 mt -68.06 -49.39 68.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.4 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 86.3 mttt -60.24 -47.09 87.46 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -174.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.64 -44.17 94.63 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.607 0.763 . . . . 0.0 110.923 -175.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.6 m -63.01 -44.5 95.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.989 0.516 . . . . 0.0 110.02 175.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.9 m -57.75 -40.66 80.22 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.759 0.824 . . . . 0.0 111.516 176.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 74.1 mt -68.55 -47.82 75.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 119.325 0.966 . . . . 0.0 109.837 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -78.22 -31.16 49.19 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -122.72 -8.25 8.47 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.674 1.19 . . . . 0.0 112.505 -169.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 85.44 166.55 42.08 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 107.968 -2.053 . . . . 0.0 107.968 -168.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -63.59 148.83 92.14 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 CA-C-N 119.403 1.602 . . . . 0.0 109.695 -179.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -134.29 17.47 3.72 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.481 -169.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -140.37 77.18 1.59 Allowed 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 126.669 1.987 . . . . 0.0 107.329 175.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 50.1 mm -128.58 143.64 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 105.494 -2.039 . . . . 0.0 105.494 -177.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 mp -132.02 -31.51 1.48 Allowed 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -169.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -163.53 163.45 16.38 Favored Pre-proline 0 C--O 1.236 0.351 0 C-N-CA 124.881 1.272 . . . . 0.0 107.596 -175.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.25 112.01 0.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.25 2.633 . . . . 0.0 111.846 171.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.17 4.69 77.54 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-O 117.471 -1.738 . . . . 0.0 114.618 176.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.49 126.89 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 119.977 1.889 . . . . 0.0 109.572 -169.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.76 171.01 12.11 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 125.879 1.672 . . . . 0.0 109.875 177.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.1 ttm -146.72 66.17 10.53 Favored Pre-proline 0 CA--C 1.54 0.578 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -50.67 137.05 42.08 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 121.178 1.252 . . . . 0.0 112.972 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -177.56 155.75 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 129.776 3.23 . . . . 0.0 105.279 -170.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.11 163.44 30.81 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.557 1.143 . . . . 0.0 108.336 171.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -52.11 139.08 35.22 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-O 118.024 -0.988 . . . . 0.0 109.413 175.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -44.67 -47.91 10.98 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.961 3.107 . . . . 0.0 113.335 -177.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -69.11 -4.26 16.56 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -175.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 73.7 m -78.94 -4.32 49.27 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.233 -0.917 . . . . 0.0 111.976 172.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 136.62 13.64 0.96 Allowed Glycine 0 CA--C 1.526 0.747 0 CA-C-N 119.485 1.039 . . . . 0.0 114.135 174.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.73 147.74 52.23 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 119.566 1.683 . . . . 0.0 108.804 169.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.2 mt -131.23 -31.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.65 1.18 . . . . 0.0 110.197 -175.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -144.91 154.61 42.79 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.311 1.444 . . . . 0.0 108.522 175.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 37.5 m -86.64 129.68 34.78 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 123.394 0.678 . . . . 0.0 109.886 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.23 -175.75 38.72 Favored Glycine 0 CA--C 1.527 0.808 0 C-N-CA 123.816 0.722 . . . . 0.0 111.313 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 49.5 mtp -145.09 170.14 16.77 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.242 1.417 . . . . 0.0 110.844 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 33.0 m -157.27 173.34 17.09 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.165 1.786 . . . . 0.0 108.701 170.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.3 tp -148.21 116.45 6.51 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.071 1.348 . . . . 0.0 110.904 -168.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 87.8 m -118.37 143.68 46.47 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 125.081 1.352 . . . . 0.0 108.746 -177.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -134.85 143.44 47.01 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 171.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.4 mp -121.72 133.08 54.94 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.124 1.77 . . . . 0.0 106.313 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -67.14 -48.04 69.24 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.793 -0.567 . . . . 0.0 110.913 177.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -88.1 -15.95 34.83 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.555 0.742 . . . . 0.0 112.001 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.92 -178.21 21.27 Favored Glycine 0 CA--C 1.532 1.1 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -168.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -145.32 167.57 9.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 169.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -121.5 93.35 3.98 Favored 'General case' 0 C--N 1.333 -0.12 0 O-C-N 121.805 -0.56 . . . . 0.0 110.799 -169.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -48.88 138.64 12.53 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 123.743 0.817 . . . . 0.0 110.616 169.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -62.93 133.35 41.1 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 122.342 2.028 . . . . 0.0 110.827 -172.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 70.82 5.84 58.22 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-O 118.244 -1.309 . . . . 0.0 114.741 172.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -73.3 168.9 18.22 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 120.07 1.935 . . . . 0.0 110.05 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -67.55 -37.43 82.67 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.552 -0.717 . . . . 0.0 111.824 176.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -155.25 167.39 14.22 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.383 1.073 . . . . 0.0 111.942 -170.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -74.89 159.81 41.24 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 123.045 2.496 . . . . 0.0 111.7 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.7 mm -113.49 138.32 43.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 21.3 mtpp -112.05 -19.63 12.25 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 117.291 -1.338 . . . . 0.0 111.03 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.6 tp -133.66 131.71 39.85 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 120.218 1.372 . . . . 0.0 109.424 -170.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.6 mp -138.4 135.1 34.94 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -175.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.0 mt -113.12 127.84 70.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 169.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.22 145.89 25.91 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 107.634 -2.186 . . . . 0.0 107.634 169.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 6.9 tt -143.62 132.6 22.84 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 169.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 85.3 p -124.39 153.39 41.94 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 169.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -152.87 133.06 13.51 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 118.343 0.52 . . . . 0.0 110.189 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.24 -22.06 58.16 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.024 0.53 . . . . 0.0 111.938 177.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -148.65 156.32 42.24 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.311 1.044 . . . . 0.0 109.642 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.41 -34.49 72.53 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -177.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.64 -30.94 61.8 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 120.749 -1.219 . . . . 0.0 111.065 177.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.1 m -67.16 -37.1 83.19 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.632 -0.668 . . . . 0.0 110.342 171.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -59.04 -49.02 79.48 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 123.857 0.863 . . . . 0.0 109.585 170.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 14.7 mm -54.29 -49.62 62.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 176.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.16 -42.79 97.32 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-N 119.199 0.908 . . . . 0.0 112.478 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.42 -40.47 67.09 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.398 0.679 . . . . 0.0 111.199 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -58.03 -47.0 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 C-N-CA 125.391 1.477 . . . . 0.0 107.501 173.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -67.74 0.15 3.55 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.347 1.459 . . . . 0.0 112.661 178.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -100.3 -54.76 2.78 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 124.824 1.25 . . . . 0.0 107.868 169.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.4 pp -64.43 -21.68 66.72 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -178.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 54.5 p -59.39 -30.39 68.41 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 123.62 0.768 . . . . 0.0 111.844 175.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -70.14 -11.15 60.68 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.545 -0.722 . . . . 0.0 110.975 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 35.2 mt -110.64 -63.62 1.37 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.115 0.966 . . . . 0.0 111.008 176.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 17.1 mt -70.6 -17.3 62.9 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -172.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.1 m -111.85 27.78 9.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.597 0.759 . . . . 0.0 110.402 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -132.8 97.7 4.11 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 107.227 -1.397 . . . . 0.0 107.227 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -57.85 -28.33 64.02 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.232 -175.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -67.27 -42.55 83.68 Favored 'General case' 0 C--O 1.23 0.072 0 CA-C-O 121.303 0.573 . . . . 0.0 109.772 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.2 mp -69.05 -42.94 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 40.2 mt -54.09 -44.98 71.66 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 118.893 -0.575 . . . . 0.0 111.061 -175.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -69.7 -34.99 74.69 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 118.244 0.475 . . . . 0.0 110.109 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -72.28 -35.22 68.66 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.946 0.794 . . . . 0.0 109.883 -177.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 28.9 mt -67.28 -52.15 44.16 Favored 'General case' 0 C--O 1.225 -0.203 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 170.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.4 -24.66 56.79 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 66.9 p -105.46 5.33 31.49 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.737 1.215 . . . . 0.0 112.122 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -56.5 116.45 3.11 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 119.181 0.9 . . . . 0.0 110.413 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.3 m -68.63 -29.39 67.88 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 125.354 1.462 . . . . 0.0 111.342 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 33.1 m -147.68 164.33 33.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.971 1.309 . . . . 0.0 109.855 -169.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -54.6 -39.08 67.49 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.14 1.376 . . . . 0.0 110.389 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -56.08 -39.89 72.8 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.939 0.896 . . . . 0.0 112.389 -176.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -61.45 -43.99 97.89 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 118.824 0.738 . . . . 0.0 110.851 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.6 mt -62.87 -49.54 74.43 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -178.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.05 -27.89 67.33 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 174.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -81.24 -39.43 25.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 119.05 0.841 . . . . 0.0 110.6 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 63.4 mt -66.95 -33.0 60.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 123.958 0.903 . . . . 0.0 109.253 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 1.1 mm -48.37 -47.77 14.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.75 1.22 . . . . 0.0 111.287 169.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 16.3 m -66.18 -18.61 65.45 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.789 0.836 . . . . 0.0 112.562 -169.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 32.1 ttp85 -53.82 -35.67 61.68 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.696 1.198 . . . . 0.0 112.93 173.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.953 0 N-CA-C 107.876 -2.09 . . . . 0.0 107.876 -173.942 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.872 0.367 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -68.12 114.18 6.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.164 -175.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.0 -34.35 74.67 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.754 175.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.1 m -55.16 -15.92 2.68 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.0 0.818 . . . . 0.0 113.079 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -62.38 -23.32 66.74 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 172.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -106.5 -19.1 13.78 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -169.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -105.58 100.46 26.79 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 120.657 1.571 . . . . 0.0 107.589 -169.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -59.51 -67.41 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.462 2.775 . . . . 0.0 114.135 -170.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.426 ' C ' ' H ' ' A' ' 11' ' ' SER . 34.8 tt0 -162.26 -72.98 0.05 Allowed 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 123.78 0.832 . . . . 0.0 111.485 -174.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.7 m -67.75 2.6 1.83 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.559 1.144 . . . . 0.0 112.009 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.426 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.2 OUTLIER -68.52 -14.84 63.28 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.825 1.65 . . . . 0.0 112.745 -169.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.4 mt -117.8 130.35 72.81 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 105.123 -2.177 . . . . 0.0 105.123 -169.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 75.8 m -156.9 149.38 23.31 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.51 0.671 . . . . 0.0 111.231 -177.675 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.4 t -117.96 141.38 37.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 105.632 -1.988 . . . . 0.0 105.632 169.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.2 mt -135.37 145.01 32.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 125.602 1.561 . . . . 0.0 107.767 -169.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -68.19 -36.3 79.37 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.878 -0.514 . . . . 0.0 111.909 176.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 p -179.54 146.61 0.28 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.802 2.041 . . . . 0.0 106.346 -177.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.79 154.12 36.47 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 169.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.53 -42.94 83.89 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.215 0.606 . . . . 0.0 109.778 174.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -166.07 177.88 6.72 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 128.34 2.656 . . . . 0.0 107.29 172.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.46 -37.49 65.27 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 126.352 1.861 . . . . 0.0 114.015 175.354 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.435 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.1 mt-30 -62.03 -50.4 72.17 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.316 1.416 . . . . 0.0 108.364 172.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -60.04 -31.33 69.86 Favored 'General case' 0 C--O 1.222 -0.348 0 O-C-N 122.039 -0.413 . . . . 0.0 111.808 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.24 -38.01 84.48 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.582 -0.699 . . . . 0.0 110.234 -179.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.9 -45.35 91.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 169.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -56.69 -44.87 81.92 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 122.696 0.398 . . . . 0.0 110.208 -176.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -69.42 -28.29 66.01 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.758 1.223 . . . . 0.0 112.466 174.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m -64.71 -20.94 66.61 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.953 1.251 . . . . 0.0 111.53 170.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.4 mmt -122.69 -21.47 5.63 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -169.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -59.26 -35.27 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 120.944 1.702 . . . . 0.0 112.16 -169.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.5 m -64.43 -30.97 72.0 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.039 0.836 . . . . 0.0 111.417 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.7 mt -77.41 -43.22 33.33 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.807 0.843 . . . . 0.0 108.821 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 28.3 tp -56.67 -41.42 77.22 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.825 0.85 . . . . 0.0 110.956 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.61 -29.1 68.35 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 124.992 1.317 . . . . 0.0 112.78 -171.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -99.71 16.45 23.49 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.09 0.405 . . . . 0.0 110.654 172.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.336 3.4 p30 44.9 46.54 9.02 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.969 1.708 . . . . 0.0 114.167 -171.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -72.73 -19.96 61.29 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.596 -0.69 . . . . 0.0 109.14 167.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 pt -142.36 172.99 7.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 127.242 2.217 . . . . 0.0 108.531 -178.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m -108.23 159.03 16.94 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.165 1.786 . . . . 0.0 108.195 170.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -60.75 -33.72 73.36 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.86 -1.15 . . . . 0.0 111.74 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -62.34 -25.63 68.0 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.273 -0.892 . . . . 0.0 113.091 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -63.3 -45.73 90.01 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 119.521 1.055 . . . . 0.0 109.591 174.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.7 mt -59.9 -51.26 74.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 124.75 1.22 . . . . 0.0 108.816 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -68.75 -24.54 64.46 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.718 -174.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.5 -42.52 82.92 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.661 1.119 . . . . 0.0 110.765 172.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 14.9 mt -69.86 -49.22 58.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.435 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.8 mttt -59.81 -42.16 92.83 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -174.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -60.42 -48.07 83.37 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.734 0.814 . . . . 0.0 111.532 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.6 m -62.55 -43.32 99.1 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.309 0.504 . . . . 0.0 110.456 176.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 42.1 m -58.97 -41.75 88.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.527 0.731 . . . . 0.0 111.29 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 65.3 mt -69.6 -41.33 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.188 0.995 . . . . 0.0 109.796 177.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.48 -34.39 76.75 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.597 0.759 . . . . 0.0 112.777 -170.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -149.63 -52.96 0.16 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.232 0.613 . . . . 0.0 110.622 -168.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.15 174.49 32.11 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 108.691 -1.764 . . . . 0.0 108.691 178.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -50.36 152.21 8.79 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 123.199 2.599 . . . . 0.0 113.583 175.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -118.34 3.93 11.89 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.488 1.115 . . . . 0.0 111.5 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -139.5 67.03 1.39 Allowed 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 124.689 1.196 . . . . 0.0 109.311 -169.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.5 mm -118.02 138.71 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -124.18 -33.36 3.09 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.255 0.622 . . . . 0.0 112.183 -169.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.51 164.19 20.0 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 124.844 1.258 . . . . 0.0 107.794 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -46.32 112.72 0.5 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.412 2.741 . . . . 0.0 111.997 172.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.41 5.38 85.04 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-O 117.792 -1.56 . . . . 0.0 114.677 176.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.9 t -127.26 122.92 60.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 120.066 1.933 . . . . 0.0 108.896 -169.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.71 171.1 10.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.802 1.641 . . . . 0.0 109.998 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 9.1 ttm -141.31 58.76 9.31 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 123.997 0.919 . . . . 0.0 111.516 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -56.32 128.12 28.83 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 121.807 1.671 . . . . 0.0 110.535 -176.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -179.11 162.69 1.24 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 127.809 2.444 . . . . 0.0 106.719 -169.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.83 171.79 13.91 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.791 1.237 . . . . 0.0 109.237 -175.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 -57.71 154.09 27.94 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-O 118.375 -0.822 . . . . 0.0 109.632 171.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.38 -40.17 83.74 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.499 2.132 . . . . 0.0 109.488 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.67 -16.97 30.29 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.948 2.099 . . . . 0.0 113.179 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 84.2 m -77.1 -9.41 58.72 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.736 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 135.78 17.26 0.84 Allowed Glycine 0 C--N 1.34 0.775 0 CA-C-O 118.234 -1.315 . . . . 0.0 113.859 175.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 148.42 51.78 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.435 1.617 . . . . 0.0 109.358 172.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.8 mt -129.24 -33.98 1.89 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 124.459 1.103 . . . . 0.0 110.685 -175.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -146.7 159.78 43.04 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.267 1.427 . . . . 0.0 108.524 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 85.2 m -92.47 125.47 37.13 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 123.379 0.672 . . . . 0.0 111.986 -175.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.62 -178.5 42.77 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 125.104 1.335 . . . . 0.0 111.294 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 13.1 mtm -147.36 169.79 18.71 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.962 1.705 . . . . 0.0 111.778 -176.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -136.88 161.02 37.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.503 1.921 . . . . 0.0 108.829 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 33.4 tp -143.03 106.28 4.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.818 2.047 . . . . 0.0 108.122 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.1 m -121.41 136.21 54.98 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -170.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tt -132.99 136.57 46.13 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 119.348 0.977 . . . . 0.0 108.404 175.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.0 mp -113.95 126.74 55.49 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 125.54 1.536 . . . . 0.0 107.311 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -61.78 -40.77 96.33 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.323 0.649 . . . . 0.0 110.892 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -96.35 -10.75 27.03 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.829 0.851 . . . . 0.0 112.175 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 61.3 -173.74 6.53 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -169.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -150.27 168.27 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 168.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -125.94 92.42 3.59 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 121.5 0.666 . . . . 0.0 110.203 -170.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -49.0 140.49 11.43 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.337 171.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -62.65 141.29 85.2 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.18 1.92 . . . . 0.0 110.081 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 73.7 -5.63 22.49 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 118.169 -1.351 . . . . 0.0 114.978 172.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -75.99 166.22 23.81 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.252 2.026 . . . . 0.0 110.056 175.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -70.98 -35.42 72.12 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.61 -0.681 . . . . 0.0 112.329 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -153.34 168.05 12.32 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 123.974 0.91 . . . . 0.0 112.161 -169.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -73.68 159.5 45.58 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.819 2.346 . . . . 0.0 111.453 178.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.0 mm -113.55 137.4 46.79 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -114.01 -15.13 12.35 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 116.519 -1.705 . . . . 0.0 111.146 175.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -138.73 144.06 39.33 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 121.249 1.841 . . . . 0.0 111.982 175.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -139.37 109.79 6.57 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.654 1.582 . . . . 0.0 107.386 -173.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -84.9 135.6 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 168.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -97.88 154.81 20.32 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 109.218 -1.553 . . . . 0.0 109.218 170.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -152.11 144.54 24.1 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 173.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 82.5 p -142.53 145.05 33.23 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 168.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.463 ' HA ' ' HA ' ' A' ' 77' ' ' THR . . . -144.1 146.91 33.11 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 119.27 0.941 . . . . 0.0 109.642 169.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.01 -14.56 59.12 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.483 -176.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -136.97 151.0 48.51 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.436 0.694 . . . . 0.0 110.202 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.43 -35.38 77.4 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -72.6 -30.39 64.32 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 121.139 -0.976 . . . . 0.0 110.917 176.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 19.6 m -66.46 -36.45 82.81 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.383 169.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -61.55 -45.79 92.66 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 119.303 0.956 . . . . 0.0 109.969 170.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 20.8 mm -55.7 -51.76 55.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 118.985 0.811 . . . . 0.0 109.274 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.26 -41.8 96.97 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-N 118.854 0.752 . . . . 0.0 111.669 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.37 -43.68 73.08 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.492 0.717 . . . . 0.0 111.22 -179.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.8 mm -59.11 -46.47 91.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 C-N-CA 124.847 1.259 . . . . 0.0 108.282 175.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -68.03 -12.05 60.1 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.352 -0.843 . . . . 0.0 111.562 -178.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -91.52 -50.16 5.93 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 124.216 1.006 . . . . 0.0 109.089 173.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.01 -26.81 65.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 121.69 -0.631 . . . . 0.0 111.478 -176.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.8 m -62.16 -22.18 65.66 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 119.118 -0.467 . . . . 0.0 112.168 173.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -65.97 -16.7 64.12 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.396 0.998 . . . . 0.0 110.336 172.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 34.1 mt -106.3 -60.91 1.59 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.612 1.565 . . . . 0.0 110.115 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 13.6 mt -69.15 -17.51 63.83 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -173.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 44.3 m -113.03 27.38 9.67 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 119.046 0.839 . . . . 0.0 110.595 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -139.31 96.87 3.17 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 -170.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.44 -25.77 38.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.296 1.038 . . . . 0.0 112.737 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.34 -45.8 89.54 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.373 0.606 . . . . 0.0 109.896 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -72.15 -38.21 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.3 mt -59.06 -33.37 70.71 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 119.312 0.96 . . . . 0.0 111.468 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -68.27 -43.34 78.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 120.858 -1.151 . . . . 0.0 110.334 172.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -64.73 -33.36 75.78 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.599 0.636 . . . . 0.0 110.665 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 2.6 pp -78.11 -45.41 23.44 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.119 175.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 53.8 mt -62.97 -24.03 67.7 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 120.225 1.375 . . . . 0.0 112.395 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 52.4 p -94.36 1.0 55.89 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.984 0.914 . . . . 0.0 111.646 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.96 107.67 2.76 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.131 0.878 . . . . 0.0 110.944 -176.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.2 p -77.42 -24.24 50.47 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.776 1.23 . . . . 0.0 112.208 176.188 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 29.8 m -147.55 157.47 43.57 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.86 0.864 . . . . 0.0 111.32 -169.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -50.04 -42.25 49.22 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.963 2.105 . . . . 0.0 111.643 177.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -70.57 -21.97 62.63 Favored 'General case' 0 CA--C 1.527 0.081 0 O-C-N 121.452 -0.78 . . . . 0.0 112.559 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -76.42 -32.2 58.36 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 120.163 1.347 . . . . 0.0 109.468 173.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.48 -43.42 76.99 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.269 -0.894 . . . . 0.0 108.642 174.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -56.44 -38.93 72.29 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 170.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.18 -39.01 91.29 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 119.154 0.888 . . . . 0.0 111.191 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 86.4 mt -62.03 -43.48 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.453 0.701 . . . . 0.0 109.578 175.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 18.0 mm -58.92 -43.56 88.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 C-N-CA 122.792 0.437 . . . . 0.0 110.299 176.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 52.3 m -72.67 -26.75 61.74 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 122.017 -0.427 . . . . 0.0 111.831 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 -70.06 -40.43 75.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.305 1.042 . . . . 0.0 110.049 174.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 C-N-CA 124.639 1.114 . . . . 0.0 110.477 -174.623 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 N--CA 1.485 1.312 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -62.31 113.08 2.7 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 168.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -53.49 -43.34 68.16 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.146 0.978 . . . . 0.0 108.794 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -54.05 -21.62 8.81 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.158 1.383 . . . . 0.0 113.69 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.99 -26.12 68.03 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.73 1.15 . . . . 0.0 112.659 173.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -97.85 -22.33 16.42 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 118.132 -0.937 . . . . 0.0 113.377 -171.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -104.04 101.16 24.11 Favored Pre-proline 0 N--CA 1.473 0.702 0 N-CA-C 105.342 -2.096 . . . . 0.0 105.342 -173.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.01 -77.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.075 2.517 . . . . 0.0 113.344 -169.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -159.54 160.09 34.12 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 127.146 2.178 . . . . 0.0 105.696 174.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 m 60.47 1.4 0.39 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.587 1.555 . . . . 0.0 112.99 -177.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.26 -7.63 55.32 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 127.543 2.337 . . . . 0.0 112.766 -169.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.5 mt -120.42 129.41 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.935 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -169.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.7 p -147.67 146.88 29.47 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.495 0.664 . . . . 0.0 112.093 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 93.7 t -127.47 136.52 60.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 171.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.0 mt -139.56 150.73 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 125.981 1.713 . . . . 0.0 106.906 -169.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 55.3 t60 -75.3 -48.78 21.6 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.838 -0.539 . . . . 0.0 109.718 172.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.1 p -157.27 150.15 23.45 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 178.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.68 156.04 26.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 170.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -59.59 -31.21 69.26 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.161 175.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -166.37 173.7 9.75 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 126.844 2.057 . . . . 0.0 107.704 177.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 1.2 p90 -64.12 -33.44 75.77 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 123.747 0.819 . . . . 0.0 111.501 169.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.412 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.5 mt-30 -59.23 -48.83 80.16 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 169.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.34 -30.89 71.78 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 122.048 -0.408 . . . . 0.0 111.438 -179.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.96 -36.8 83.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.529 -0.732 . . . . 0.0 110.026 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.32 -45.64 92.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 169.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -56.65 -45.92 81.35 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.766 0.427 . . . . 0.0 110.296 -177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -67.14 -31.04 71.21 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.872 1.269 . . . . 0.0 112.172 174.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.1 m -64.61 -21.81 66.81 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.875 1.216 . . . . 0.0 111.979 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.6 mmt -123.36 -20.48 5.61 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -169.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -60.99 -34.18 58.78 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-N 121.03 1.741 . . . . 0.0 111.595 -171.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.0 m -62.35 -26.44 68.45 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.778 0.717 . . . . 0.0 111.755 178.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.0 mt -84.83 -40.97 16.52 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.105 0.962 . . . . 0.0 109.179 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.3 tp -56.4 -40.92 75.44 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.775 0.83 . . . . 0.0 110.828 178.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -66.62 -25.44 66.6 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 125.827 1.651 . . . . 0.0 113.788 -171.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -110.82 23.62 13.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.768 0.427 . . . . 0.0 110.019 172.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.305 3.7 p30 45.39 43.06 8.2 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.483 1.513 . . . . 0.0 114.191 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.409 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 41.5 m-85 -71.18 -18.4 62.49 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.329 -0.857 . . . . 0.0 109.076 168.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 pt -145.8 170.77 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.323 2.249 . . . . 0.0 108.734 -178.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.4 m -107.44 161.19 15.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.052 1.741 . . . . 0.0 108.071 169.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -61.32 -30.94 70.81 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.066 -1.021 . . . . 0.0 112.349 -174.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -57.15 -36.2 70.45 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.686 -0.634 . . . . 0.0 111.823 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -58.07 -45.16 87.56 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 123.834 0.854 . . . . 0.0 110.319 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.7 mt -61.83 -50.7 79.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 124.771 1.228 . . . . 0.0 108.486 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -68.29 -26.57 65.71 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 118.089 -0.958 . . . . 0.0 111.924 -174.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.77 -44.91 86.52 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.491 1.041 . . . . 0.0 110.477 173.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.6 mt -69.28 -48.55 67.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 86.7 mttt -58.75 -47.68 83.81 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -175.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.79 -44.04 94.55 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 123.996 0.918 . . . . 0.0 111.012 -176.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -61.22 -44.06 97.88 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 122.743 0.417 . . . . 0.0 110.129 176.011 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.1 m -61.09 -42.59 98.78 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.07 0.948 . . . . 0.0 111.164 178.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 73.5 mt -65.27 -42.32 93.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-N 118.783 0.72 . . . . 0.0 109.481 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -70.13 -38.44 75.53 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -171.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -144.97 12.84 1.44 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 80.87 168.42 39.38 Favored Glycine 0 CA--C 1.533 1.218 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -172.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -65.36 157.76 56.19 Favored 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 123.164 2.576 . . . . 0.0 112.22 -172.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -112.39 -11.24 13.69 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.081 0.952 . . . . 0.0 112.571 -170.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -136.54 77.95 1.68 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.242 1.017 . . . . 0.0 108.5 -169.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.6 mm -124.14 141.5 44.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 mp -130.38 -28.39 2.1 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -169.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.13 161.03 26.54 Favored Pre-proline 0 C--O 1.237 0.396 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -56.72 114.52 1.95 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.017 1.811 . . . . 0.0 109.238 172.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.14 -4.87 57.41 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-O 117.792 -1.56 . . . . 0.0 114.2 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.1 t -129.22 128.53 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.93 1.865 . . . . 0.0 110.212 -169.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -131.67 167.39 19.54 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.292 1.837 . . . . 0.0 109.938 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 8.8 ttm -139.94 57.12 8.87 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.006 0.922 . . . . 0.0 112.151 -179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -45.81 138.08 11.97 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 121.863 1.709 . . . . 0.0 114.175 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 178.44 154.88 0.39 Allowed 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 129.121 2.968 . . . . 0.0 105.67 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -133.72 161.43 34.71 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 170.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -56.64 149.36 41.54 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-O 118.687 -0.673 . . . . 0.0 109.351 178.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -47.72 -41.01 31.54 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 123.131 2.554 . . . . 0.0 112.767 -177.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -62.74 -15.44 53.12 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.352 1.461 . . . . 0.0 113.285 -177.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 84.7 m -79.8 -2.01 41.4 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.86 0.864 . . . . 0.0 111.705 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.99 20.07 1.51 Allowed Glycine 0 CA--C 1.523 0.548 0 CA-C-O 118.493 -1.171 . . . . 0.0 112.941 174.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.39 148.91 48.97 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 119.415 1.607 . . . . 0.0 108.665 169.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.7 mt -129.53 -33.69 1.85 Allowed 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.259 1.024 . . . . 0.0 110.529 -176.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.409 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 73.7 mttt -145.67 153.85 41.46 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 125.281 1.432 . . . . 0.0 107.694 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.7 m -84.8 126.55 33.53 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 122.854 0.462 . . . . 0.0 109.985 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.95 179.67 42.13 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.665 1.126 . . . . 0.0 110.385 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 60.3 mtp -147.82 168.47 22.1 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.298 1.039 . . . . 0.0 112.767 -173.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -138.65 164.14 30.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.251 1.821 . . . . 0.0 109.441 174.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 31.3 tp -146.77 100.93 3.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.135 2.174 . . . . 0.0 108.837 177.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 92.2 m -117.27 135.19 54.0 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.316 1.046 . . . . 0.0 109.407 -172.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.4 tp -124.99 139.22 54.01 Favored 'General case' 0 CA--C 1.526 0.036 0 C-N-CA 123.795 0.838 . . . . 0.0 108.833 174.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mp -118.3 126.41 52.07 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 126.519 1.928 . . . . 0.0 105.828 175.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -72.23 -35.23 68.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 119.039 0.836 . . . . 0.0 112.31 -178.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 52.1 mm-40 -81.07 -20.08 42.33 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.633 0.773 . . . . 0.0 111.241 172.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 65.2 -174.5 16.5 Favored Glycine 0 CA--C 1.532 1.142 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 -168.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -146.7 165.38 7.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 105.779 -1.934 . . . . 0.0 105.779 168.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -126.75 94.3 4.01 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -169.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -47.17 146.28 3.11 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 124.478 1.111 . . . . 0.0 110.948 174.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.5 -5.25 8.13 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.58 3.52 . . . . 0.0 117.858 -168.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.39 23.03 0.85 Allowed Glycine 0 CA--C 1.524 0.625 0 CA-C-N 120.119 1.327 . . . . 0.0 113.245 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -85.19 171.66 11.8 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 118.671 1.236 . . . . 0.0 111.792 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -67.33 -42.69 83.16 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.884 0.473 . . . . 0.0 111.771 174.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -156.56 170.1 9.45 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 124.848 1.259 . . . . 0.0 111.652 -176.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -62.99 158.05 45.51 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.633 2.222 . . . . 0.0 112.558 177.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 40.5 mm -116.82 132.4 66.64 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 106.97 -1.493 . . . . 0.0 106.97 178.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -98.63 -35.48 10.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 117.658 -1.163 . . . . 0.0 109.55 169.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -115.51 129.96 56.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 119.804 1.184 . . . . 0.0 110.512 -169.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mp -131.38 104.74 7.18 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -80.27 138.96 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 168.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -99.42 148.88 18.81 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 108.312 -1.915 . . . . 0.0 108.312 169.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.75 137.55 25.21 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.001 -1.851 . . . . 0.0 106.001 169.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 92.6 p -132.07 147.44 52.44 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 126.305 1.842 . . . . 0.0 106.188 168.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -148.0 133.6 18.79 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -178.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.15 -18.53 59.08 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.239 -0.41 . . . . 0.0 111.781 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -144.25 153.38 41.98 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.852 0.861 . . . . 0.0 110.079 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.17 -35.23 74.88 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.48 -31.12 62.1 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 120.933 -1.104 . . . . 0.0 111.086 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.9 m -64.63 -39.2 93.29 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.845 -0.534 . . . . 0.0 110.261 170.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -58.55 -49.97 75.48 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 123.508 0.723 . . . . 0.0 109.798 171.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 16.4 mm -55.29 -52.13 48.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.94 -41.0 99.19 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 118.971 0.805 . . . . 0.0 111.761 -176.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.27 -46.61 73.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.483 0.713 . . . . 0.0 110.725 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.2 mm -57.72 -46.71 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 124.853 1.261 . . . . 0.0 108.632 176.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -68.21 -14.91 63.34 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.299 -0.876 . . . . 0.0 111.512 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -90.15 -47.38 7.84 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 123.895 0.878 . . . . 0.0 109.539 174.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 4.3 pp -70.58 -25.83 63.25 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 121.75 -0.594 . . . . 0.0 111.51 -176.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.0 m -60.77 -21.99 63.61 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 172.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.72 -17.13 64.7 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.35 0.977 . . . . 0.0 110.268 173.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 44.9 mt -105.71 -61.85 1.44 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.26 1.424 . . . . 0.0 109.883 177.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 16.6 mt -68.97 -12.73 61.93 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -173.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.3 m -118.38 29.04 7.99 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.993 0.815 . . . . 0.0 110.4 177.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -131.86 99.71 4.84 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.577 1.151 . . . . 0.0 108.052 175.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -57.47 -25.6 59.96 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.038 -0.983 . . . . 0.0 112.488 -176.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -62.68 -48.98 76.91 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.139 0.576 . . . . 0.0 109.822 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.64 -41.26 85.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 123.9 0.88 . . . . 0.0 108.814 178.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 34.5 mt -53.91 -43.44 69.73 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 118.64 0.655 . . . . 0.0 111.605 -172.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -69.87 -32.31 70.6 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.449 0.568 . . . . 0.0 110.234 -178.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -71.18 -36.68 72.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -178.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 48.6 mt -62.24 -55.57 27.13 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 169.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 58.2 mt -62.42 -9.43 8.35 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -172.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 67.9 p -121.78 4.83 10.0 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.342 1.457 . . . . 0.0 111.546 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.53 113.01 2.21 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.054 0.942 . . . . 0.0 110.527 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.1 m -75.16 -22.49 58.07 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.632 0.773 . . . . 0.0 111.942 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.2 m -147.13 155.49 42.19 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.867 0.867 . . . . 0.0 109.895 -169.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -62.18 -31.93 72.49 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 123.775 0.83 . . . . 0.0 110.506 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -57.61 -36.5 71.85 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 123.06 0.544 . . . . 0.0 111.756 173.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -68.15 -38.07 81.74 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.75 0.82 . . . . 0.0 111.438 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 59.4 mt -68.46 -46.56 69.44 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -56.97 -35.2 68.87 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.277 1.031 . . . . 0.0 112.83 173.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -63.22 -45.18 92.82 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 119.36 0.982 . . . . 0.0 110.064 176.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 83.6 mt -62.73 -37.62 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 C-N-CA 123.955 0.902 . . . . 0.0 109.936 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 25.0 mm -60.39 -49.01 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 118.412 0.551 . . . . 0.0 110.409 170.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 44.2 m -66.16 -24.96 66.74 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -168.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -65.31 -33.52 76.17 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.85 0.75 . . . . 0.0 111.118 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.132 0 CA-C-O 117.52 -1.711 . . . . 0.0 109.197 -169.398 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.0 ttm . . . . . 0 N--CA 1.487 1.396 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -64.17 114.27 4.09 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -54.35 -43.73 71.55 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.141 1.376 . . . . 0.0 109.457 -178.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.8 -18.43 8.52 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.246 1.418 . . . . 0.0 113.183 -177.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -66.99 -31.12 71.46 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.449 1.022 . . . . 0.0 111.648 176.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -87.86 -30.65 20.0 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.508 -0.758 . . . . 0.0 112.346 -173.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -91.13 109.81 37.97 Favored Pre-proline 0 CA--C 1.543 0.706 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -176.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.3 -83.55 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.835 2.357 . . . . 0.0 112.625 -169.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -157.39 163.21 38.82 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 127.257 2.223 . . . . 0.0 106.113 172.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 57.58 5.06 0.28 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.771 1.628 . . . . 0.0 113.125 -175.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.4 p -81.98 1.28 36.21 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.734 2.814 . . . . 0.0 113.393 -168.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.4 mt -131.61 123.26 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -169.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.0 m -142.6 146.42 34.54 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 123.413 0.446 . . . . 0.0 111.488 -176.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -118.81 141.25 39.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 105.496 -2.039 . . . . 0.0 105.496 169.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.3 mt -140.69 148.23 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 C-N-CA 125.714 1.606 . . . . 0.0 107.441 -169.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -69.37 -52.62 25.36 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 172.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 t -162.03 163.56 28.72 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 169.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.93 158.45 21.57 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.92 -0.771 . . . . 0.0 108.92 173.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -59.07 -43.43 91.75 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.419 174.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -164.53 177.41 8.14 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 128.031 2.532 . . . . 0.0 107.555 173.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -55.52 -37.88 68.49 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.028 1.731 . . . . 0.0 113.819 176.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.401 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.9 mt-30 -62.64 -49.71 74.09 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 120.158 1.345 . . . . 0.0 108.489 173.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -60.41 -33.28 72.28 Favored 'General case' 0 C--O 1.223 -0.314 0 O-C-N 121.906 -0.496 . . . . 0.0 111.707 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.32 -37.3 86.67 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.645 -0.66 . . . . 0.0 110.637 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.97 -47.14 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 170.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -58.87 -48.97 79.51 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 123.266 0.626 . . . . 0.0 110.374 -174.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -60.81 -31.32 70.72 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.508 1.123 . . . . 0.0 111.4 173.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.9 m -82.66 -9.02 59.56 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 119.566 1.075 . . . . 0.0 113.676 179.214 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 14.2 mmt -121.26 -20.93 6.54 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.12 0.873 . . . . 0.0 112.821 -176.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.8 p -57.47 -34.03 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 120.352 1.433 . . . . 0.0 111.982 -173.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.0 m -65.07 -29.43 70.31 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.211 0.914 . . . . 0.0 111.902 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.2 mt -79.5 -42.47 25.15 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.092 0.957 . . . . 0.0 108.737 173.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.6 -44.01 85.11 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.921 0.888 . . . . 0.0 110.763 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.6 -28.76 67.46 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 126.651 1.98 . . . . 0.0 113.136 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -111.4 21.06 16.65 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.292 0.7 OUTLIER 47.99 33.44 3.44 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.132 1.773 . . . . 0.0 114.67 -178.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -67.86 -22.18 65.13 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.865 -1.147 . . . . 0.0 111.318 169.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.1 pt -145.37 172.59 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 C-N-CA 126.26 1.824 . . . . 0.0 108.235 -174.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 m -108.98 161.04 15.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.618 1.567 . . . . 0.0 108.366 172.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.57 -32.54 72.64 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.863 -1.148 . . . . 0.0 111.464 -178.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -59.01 -36.31 74.71 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.771 -0.581 . . . . 0.0 111.877 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -58.73 -48.24 81.84 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 123.386 0.674 . . . . 0.0 109.487 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 28.8 mt -57.97 -49.91 79.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 124.336 1.054 . . . . 0.0 108.923 178.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -68.19 -26.96 66.0 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.06 -0.971 . . . . 0.0 111.831 -175.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.24 -40.1 89.06 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.812 1.187 . . . . 0.0 110.815 172.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.7 mt -67.97 -51.91 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.0 mttt -58.9 -43.84 91.08 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -175.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -63.76 -45.76 88.35 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.465 1.106 . . . . 0.0 111.124 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 27.7 m -63.22 -38.2 90.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.402 0.546 . . . . 0.0 110.794 177.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 88.0 m -60.81 -48.46 81.68 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.136 0.974 . . . . 0.0 109.578 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.11 -42.07 93.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 C-N-CA 123.261 0.624 . . . . 0.0 110.195 178.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -70.55 -36.8 73.87 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -171.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -144.77 -45.6 0.24 Allowed 'General case' 0 C--O 1.231 0.12 0 C-N-CA 122.933 0.493 . . . . 0.0 111.691 -168.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 154.12 164.82 13.13 Favored Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 177.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -58.21 144.37 95.63 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.36 2.707 . . . . 0.0 111.275 -177.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.08 -40.72 64.26 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.827 1.251 . . . . 0.0 113.656 -170.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -150.76 140.58 21.83 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.7 mm -131.22 134.33 61.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 102.179 -3.267 . . . . 0.0 102.179 172.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -116.92 -28.92 6.15 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -168.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -165.73 163.67 12.42 Favored Pre-proline 0 C--O 1.237 0.437 0 C-N-CA 125.311 1.444 . . . . 0.0 107.536 -177.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -46.52 116.88 1.76 Allowed 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 123.027 2.485 . . . . 0.0 110.993 169.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.8 0.93 83.28 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.47 -1.739 . . . . 0.0 114.888 175.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.2 t -127.83 126.59 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 120.232 2.016 . . . . 0.0 109.605 -170.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.15 164.58 22.17 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 125.595 1.558 . . . . 0.0 110.06 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 tmm? -149.05 76.95 9.35 Favored Pre-proline 0 C--O 1.223 -0.313 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -59.04 -89.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 122.849 2.366 . . . . 0.0 114.985 -169.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . 0.254 0.0 OUTLIER 51.26 177.15 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.025 2.13 . . . . 0.0 113.943 -169.176 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.53 159.88 40.21 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 125.307 1.443 . . . . 0.0 108.568 177.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -62.53 147.78 91.75 Favored Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.09 177.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -44.58 -44.42 13.76 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 124.479 3.452 . . . . 0.0 114.032 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.42 -12.04 12.86 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.286 1.435 . . . . 0.0 113.843 -176.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 60.0 m -79.28 -4.15 49.38 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.615 0.643 . . . . 0.0 111.62 179.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 127.36 19.2 1.93 Allowed Glycine 0 C--N 1.337 0.622 0 CA-C-O 118.539 -1.145 . . . . 0.0 113.249 175.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.49 149.32 50.23 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 119.206 1.503 . . . . 0.0 109.075 169.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -130.78 -31.52 1.74 Allowed 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.375 1.07 . . . . 0.0 110.661 -174.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -146.18 157.35 43.82 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.011 1.324 . . . . 0.0 108.951 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.7 m -90.31 126.15 35.76 Favored 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 123.041 0.536 . . . . 0.0 110.203 -177.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -168.98 -174.52 37.62 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 125.482 1.515 . . . . 0.0 111.252 -175.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 40.8 mtt -151.42 170.06 20.5 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.103 1.761 . . . . 0.0 111.064 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 36.6 m -153.41 169.65 22.63 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.56 1.544 . . . . 0.0 109.931 171.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 18.1 tp -142.91 130.18 20.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 127.145 2.178 . . . . 0.0 109.561 -169.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 35.7 m -136.52 133.86 36.93 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 17.3 tp -125.38 134.51 52.14 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 171.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.5 mp -110.63 133.52 53.25 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 173.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -67.6 -43.87 79.46 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 118.308 0.504 . . . . 0.0 110.676 176.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -84.54 -24.73 29.17 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.806 0.842 . . . . 0.0 112.271 -177.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 71.69 165.54 7.27 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -168.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -135.2 163.47 35.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 169.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -120.55 93.36 4.02 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.867 0.841 . . . . 0.0 111.422 -168.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -49.89 140.09 16.13 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 114.66 -1.154 . . . . 0.0 112.221 171.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -65.25 159.25 48.06 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.36 2.04 . . . . 0.0 109.835 169.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.18 -35.14 1.5 Allowed Glycine 0 CA--C 1.534 1.232 0 C-N-CA 124.373 0.987 . . . . 0.0 113.039 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -68.79 177.87 2.37 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.079 1.352 . . . . 0.0 110.25 169.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -114.0 -20.09 11.16 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.295 1.038 . . . . 0.0 113.256 -174.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -149.66 163.26 25.6 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -58.16 152.87 49.51 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.31 2.673 . . . . 0.0 112.93 176.453 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.6 mm -115.81 128.23 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 174.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -94.43 -34.01 12.9 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.458 -1.258 . . . . 0.0 109.858 169.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -119.51 131.15 55.5 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 120.333 1.424 . . . . 0.0 110.17 -169.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mp -129.37 135.4 48.67 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -111.32 132.16 60.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 168.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -103.38 157.46 17.66 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -146.95 154.59 41.44 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 -179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 88.3 p -142.85 146.15 33.85 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 104.63 -2.359 . . . . 0.0 104.63 168.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.23 129.43 12.77 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 119.535 1.061 . . . . 0.0 108.987 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -74.57 -18.92 60.5 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.819 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -141.86 151.97 43.2 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 123.715 0.806 . . . . 0.0 110.328 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.65 -33.66 73.13 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -175.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -78.21 -31.06 49.21 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 119.313 0.96 . . . . 0.0 111.061 177.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.0 m -62.81 -39.4 94.18 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 169.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.91 -48.34 80.17 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.387 1.075 . . . . 0.0 110.483 171.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.5 mm -58.71 -51.89 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.49 -38.8 95.43 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 118.912 0.778 . . . . 0.0 111.651 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.8 -53.5 39.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.306 1.042 . . . . 0.0 110.394 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.4 mm -51.17 -48.16 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.663 1.585 . . . . 0.0 108.56 176.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -68.27 -16.09 63.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.425 0.69 . . . . 0.0 112.006 -176.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -87.5 -44.83 11.0 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.631 0.773 . . . . 0.0 109.613 172.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.8 pp -68.78 -25.77 64.87 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 118.662 0.664 . . . . 0.0 111.316 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 49.1 m -60.79 -21.88 63.53 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 123.759 0.823 . . . . 0.0 112.32 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -66.5 -17.68 64.94 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.307 0.958 . . . . 0.0 110.299 173.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 36.1 mt -105.95 -58.69 1.88 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.382 1.473 . . . . 0.0 109.898 177.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.8 -28.13 65.7 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 114.433 1.272 . . . . 0.0 114.433 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 42.0 m -108.52 26.73 10.15 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.912 0.778 . . . . 0.0 110.844 -175.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -132.42 97.51 4.12 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 124.679 1.192 . . . . 0.0 108.054 178.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.54 -27.46 49.06 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.841 0.856 . . . . 0.0 112.526 -177.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.13 -44.83 87.42 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.104 0.562 . . . . 0.0 110.013 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.62 -44.98 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 174.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.8 mt -53.74 -45.73 70.62 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 118.429 0.559 . . . . 0.0 111.555 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -65.78 -38.55 89.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.435 0.561 . . . . 0.0 110.705 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -70.1 -32.45 70.51 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 118.64 0.654 . . . . 0.0 110.11 -177.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 25.6 mt -68.75 -52.97 24.82 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 55.1 mt -59.17 -13.12 6.37 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -176.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 81.4 p -123.84 10.87 8.97 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.223 1.409 . . . . 0.0 110.898 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.01 119.02 5.58 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 124.624 1.17 . . . . 0.0 109.879 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.5 p -71.95 -16.17 62.09 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.321 1.048 . . . . 0.0 112.307 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 73.4 p -159.38 164.87 34.31 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.571 0.623 . . . . 0.0 111.067 -172.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.27 -33.81 75.35 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 169.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -60.36 -37.47 80.8 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 121.827 -0.545 . . . . 0.0 111.573 174.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -77.28 -28.54 53.43 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 119.703 1.138 . . . . 0.0 110.713 179.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 35.2 mt -65.44 -48.63 72.09 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 120.286 1.403 . . . . 0.0 108.289 169.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.04 -34.1 69.71 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.821 1.248 . . . . 0.0 113.189 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -63.17 -42.01 99.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 119.066 0.848 . . . . 0.0 110.487 176.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 91.4 mt -68.47 -36.54 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 123.343 0.657 . . . . 0.0 109.527 179.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.3 mm -57.85 -52.64 55.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 169.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 28.8 m -64.11 -28.02 69.49 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 122.816 0.446 . . . . 0.0 111.484 -170.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -59.64 -28.5 67.28 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.675 1.59 . . . . 0.0 113.396 175.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.911 0 N-CA-C 108.904 -1.679 . . . . 0.0 108.904 -174.452 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 tpt . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -65.98 110.0 2.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 168.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.51 -45.99 66.46 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.683 0.793 . . . . 0.0 109.746 -175.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.47 -19.93 6.66 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.279 1.832 . . . . 0.0 113.143 -176.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.4 -31.47 72.15 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 119.349 0.977 . . . . 0.0 111.995 175.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -88.3 -22.38 23.92 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.686 -174.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -99.4 100.14 9.9 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 -173.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.18 -81.13 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 123.689 2.926 . . . . 0.0 113.298 -169.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -157.05 161.03 39.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.43 2.292 . . . . 0.0 105.485 172.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 m 59.06 -0.12 0.15 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.568 1.547 . . . . 0.0 113.075 -174.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.1 p -80.05 4.65 16.43 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 128.397 2.679 . . . . 0.0 112.708 -169.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 6.6 mt -133.32 132.04 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 N-CA-C 104.145 -2.539 . . . . 0.0 104.145 -173.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.0 m -156.15 147.4 22.44 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 118.685 0.675 . . . . 0.0 111.066 -179.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 85.3 t -116.67 143.45 26.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 169.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mt -138.7 147.51 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 C-N-CA 126.245 1.818 . . . . 0.0 106.31 -172.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -72.47 -47.51 48.18 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.594 -0.691 . . . . 0.0 109.713 172.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.2 p -160.67 141.91 12.0 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.073 -1.455 . . . . 0.0 107.073 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.82 155.1 35.71 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -56.34 -44.83 80.42 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.631 0.772 . . . . 0.0 109.716 177.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -163.58 -176.92 4.93 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.824 2.05 . . . . 0.0 108.242 170.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -64.3 -32.79 74.52 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.455 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 35.0 mt-30 -58.88 -50.52 73.69 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.805 1.639 . . . . 0.0 107.206 171.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -60.73 -35.22 75.8 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 121.795 -0.566 . . . . 0.0 111.806 177.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.97 -31.94 72.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 121.894 -0.504 . . . . 0.0 110.905 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.25 -48.53 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 170.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -55.96 -45.63 78.84 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 118.23 0.468 . . . . 0.0 110.442 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -64.69 -28.91 69.92 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 118.031 -0.985 . . . . 0.0 112.343 174.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.9 m -69.9 -19.95 63.39 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.223 1.374 . . . . 0.0 112.224 172.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.2 mmt -123.86 -18.68 5.93 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -168.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.2 p -57.03 -37.88 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 120.273 1.397 . . . . 0.0 112.591 -169.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.3 m -67.21 -27.7 67.46 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.825 0.738 . . . . 0.0 111.568 -178.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.4 mt -77.43 -44.37 29.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.649 0.78 . . . . 0.0 108.986 172.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -56.4 -51.02 69.91 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.109 0.964 . . . . 0.0 110.092 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -56.21 -28.59 58.85 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 126.576 1.95 . . . . 0.0 113.757 -176.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -113.71 24.45 12.12 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 123.057 0.543 . . . . 0.0 109.996 -175.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 61.66 20.69 11.54 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 171.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -71.24 -24.18 62.14 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.894 -1.129 . . . . 0.0 111.158 174.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.4 pt -143.88 176.3 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.101 1.76 . . . . 0.0 108.929 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m -114.26 160.56 18.9 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.597 1.959 . . . . 0.0 108.203 175.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -59.02 -37.47 76.98 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.907 1.231 . . . . 0.0 111.826 -175.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -60.71 -22.54 64.07 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.797 0.839 . . . . 0.0 113.206 175.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -65.25 -45.58 83.98 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.798 1.181 . . . . 0.0 109.934 174.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.99 -50.53 79.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -69.86 -23.86 63.34 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.952 -173.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.01 -42.7 90.74 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 120.149 1.341 . . . . 0.0 111.025 172.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.5 mt -70.09 -46.3 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.455 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.5 mttt -61.64 -40.62 95.55 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -65.13 -38.55 91.01 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 124.176 0.99 . . . . 0.0 111.445 178.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.9 m -61.72 -42.05 98.43 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.733 -0.604 . . . . 0.0 109.603 171.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 22.6 m -63.33 -35.36 80.11 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.463 -0.773 . . . . 0.0 110.915 177.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 84.6 mt -65.94 -42.39 91.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 119.262 0.937 . . . . 0.0 110.074 172.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -63.64 -34.52 78.02 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.527 0.731 . . . . 0.0 112.545 -169.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -149.83 -44.94 0.13 Allowed 'General case' 0 C--O 1.231 0.121 0 C-N-CA 122.998 0.519 . . . . 0.0 111.918 -169.126 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.23 -179.72 20.52 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 107.887 -2.085 . . . . 0.0 107.887 -169.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.98 136.77 67.71 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 121.975 1.783 . . . . 0.0 110.362 -179.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -100.34 -6.67 25.47 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.967 0.907 . . . . 0.0 112.001 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -129.01 78.0 1.83 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 -169.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.6 mm -124.91 136.02 62.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -121.97 -31.26 3.94 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 123.651 0.78 . . . . 0.0 110.923 -172.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.77 160.21 30.16 Favored Pre-proline 0 CA--C 1.534 0.351 0 C-N-CA 125.883 1.673 . . . . 0.0 106.708 173.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -49.84 119.91 5.36 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.394 2.063 . . . . 0.0 109.979 169.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.9 -6.2 73.07 Favored Glycine 0 CA--C 1.532 1.104 0 CA-C-O 117.843 -1.532 . . . . 0.0 114.465 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.6 t -126.25 117.35 48.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 119.769 1.785 . . . . 0.0 108.339 -170.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -118.76 168.8 10.4 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.412 1.085 . . . . 0.0 110.246 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 7.2 ttm -140.69 62.31 17.72 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 122.93 0.492 . . . . 0.0 111.99 177.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.59 135.64 48.54 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 121.56 1.506 . . . . 0.0 111.83 -179.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 176.42 157.61 0.27 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 128.28 2.632 . . . . 0.0 106.221 -170.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.13 163.92 30.46 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.207 1.403 . . . . 0.0 108.224 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -58.11 153.91 32.89 Favored Pre-proline 0 N--CA 1.465 0.312 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.104 175.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.3 -39.21 91.56 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 122.13 1.886 . . . . 0.0 110.446 -172.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -61.86 -15.31 41.27 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.704 1.602 . . . . 0.0 113.055 -178.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 83.7 m -79.11 -8.61 59.12 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.656 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 139.02 13.5 0.69 Allowed Glycine 0 C--N 1.339 0.736 0 CA-C-O 117.825 -1.542 . . . . 0.0 114.206 173.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.29 147.49 52.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.854 1.827 . . . . 0.0 109.625 173.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.1 mt -130.6 -35.55 1.48 Allowed 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.309 1.043 . . . . 0.0 110.32 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -148.6 158.34 44.06 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.292 1.437 . . . . 0.0 108.542 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.454 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 83.4 m -90.29 133.74 34.75 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 122.988 0.515 . . . . 0.0 111.927 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -177.34 -179.14 47.49 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.923 1.249 . . . . 0.0 111.11 -177.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 24.2 mtm -146.65 169.67 18.53 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 126.241 1.816 . . . . 0.0 110.775 -179.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.0 m -151.04 170.61 18.96 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.473 1.509 . . . . 0.0 109.425 171.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.9 tp -145.78 131.02 18.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 127.854 2.461 . . . . 0.0 108.408 -169.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 28.6 m -140.78 137.19 33.18 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -173.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -129.27 141.44 51.11 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 172.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.7 mp -119.61 126.83 52.12 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 126.398 1.879 . . . . 0.0 106.368 176.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.42 -44.73 90.32 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.423 0.556 . . . . 0.0 111.251 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 38.1 mm-40 -85.53 -23.54 27.65 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 124.292 1.037 . . . . 0.0 111.667 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 73.97 176.18 33.75 Favored Glycine 0 CA--C 1.532 1.145 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -168.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.93 160.27 13.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 169.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -109.76 101.61 10.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.67 0.748 . . . . 0.0 110.543 -168.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -63.54 141.72 97.9 Favored Pre-proline 0 CA--C 1.541 0.633 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.448 169.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -61.17 129.65 29.36 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.116 2.544 . . . . 0.0 112.029 -169.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 68.27 9.63 58.05 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-O 118.51 -1.161 . . . . 0.0 114.639 172.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -74.69 168.29 20.13 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.581 1.691 . . . . 0.0 111.195 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -61.17 -40.94 95.77 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.969 -0.457 . . . . 0.0 111.946 178.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -158.25 164.95 19.66 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 124.725 1.21 . . . . 0.0 110.915 178.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -48.98 142.9 18.86 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.632 2.888 . . . . 0.0 113.407 169.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 22.9 mm -84.93 136.32 23.01 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.291 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 172.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -111.59 -18.46 12.8 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 117.686 -1.149 . . . . 0.0 110.625 170.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 15.3 tp -140.4 135.56 32.21 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 120.001 1.273 . . . . 0.0 109.818 -173.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.3 mp -138.6 138.37 37.84 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 -174.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.1 mt -115.24 128.93 72.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 168.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.28 149.95 21.66 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 108.592 -1.803 . . . . 0.0 108.592 170.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -148.6 144.82 27.48 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 172.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 77.9 p -142.48 145.95 34.25 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 168.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.454 ' HA ' ' HA ' ' A' ' 77' ' ' THR . . . -145.96 145.85 30.81 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 118.553 0.615 . . . . 0.0 109.706 171.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.89 -16.94 59.96 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.477 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -137.61 155.8 48.78 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.362 0.665 . . . . 0.0 110.746 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.37 -38.62 90.27 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.342 0.657 . . . . 0.0 112.472 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -73.05 -31.1 64.2 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.211 -0.93 . . . . 0.0 110.837 178.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.3 m -64.36 -37.99 89.44 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.289 169.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -62.23 -44.64 96.1 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.779 171.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.6 -51.28 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-N 119.141 0.882 . . . . 0.0 108.874 177.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.59 -40.72 96.74 Favored Glycine 0 CA--C 1.531 1.063 0 CA-C-N 119.063 0.847 . . . . 0.0 111.916 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.15 70.7 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.617 0.767 . . . . 0.0 111.096 -179.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 5.0 mm -58.91 -46.12 91.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 125.201 1.4 . . . . 0.0 108.168 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.1 mm-40 -69.02 -9.97 55.18 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.135 -0.978 . . . . 0.0 111.623 -178.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.41 -50.63 5.54 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.929 0.892 . . . . 0.0 108.93 172.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.9 pp -68.52 -27.34 66.02 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.773 -0.579 . . . . 0.0 111.646 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.4 m -62.42 -20.98 65.04 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.318 0.508 . . . . 0.0 112.062 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -64.16 -19.12 65.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.283 0.947 . . . . 0.0 110.096 171.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 33.4 mt -108.12 -60.54 1.71 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.022 1.729 . . . . 0.0 110.941 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.4 mt -65.75 -18.13 65.11 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -175.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.6 m -111.39 26.84 10.25 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.268 0.94 . . . . 0.0 110.887 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -139.54 97.47 3.28 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -172.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -55.83 -27.39 51.24 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.789 0.836 . . . . 0.0 112.418 -175.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -61.95 -45.08 95.22 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 122.875 0.47 . . . . 0.0 110.125 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.5 mp -71.69 -45.04 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 123.662 0.785 . . . . 0.0 108.887 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.0 mt -55.69 -41.67 74.06 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.026 -172.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -70.83 -33.98 71.22 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 118.435 0.561 . . . . 0.0 110.327 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -66.13 -41.65 90.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.222 0.919 . . . . 0.0 108.764 179.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 21.4 mt -69.02 -48.08 63.86 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 64.1 mt -62.66 -5.9 3.1 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 178.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 73.8 p -122.6 11.73 9.89 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.346 1.458 . . . . 0.0 110.923 175.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.17 110.09 2.07 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 124.378 1.071 . . . . 0.0 109.974 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -73.99 -14.71 61.07 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.782 0.833 . . . . 0.0 112.303 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 82.1 p -151.73 163.74 38.48 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 118.943 0.792 . . . . 0.0 110.866 -174.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.74 -39.67 74.4 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.523 1.129 . . . . 0.0 109.671 169.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -59.93 -40.01 87.47 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 123.27 0.628 . . . . 0.0 110.84 177.83 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -65.85 -38.76 89.73 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 118.865 0.757 . . . . 0.0 112.261 177.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.3 mt -62.79 -48.24 79.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.637 1.108 . . . . 0.0 108.517 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.74 -37.19 73.17 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.561 1.145 . . . . 0.0 113.66 174.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.83 -39.72 95.21 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 121.187 -0.946 . . . . 0.0 110.099 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 49.9 mt -71.93 -35.76 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 123.718 0.807 . . . . 0.0 110.206 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 17.1 mm -57.01 -46.28 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 118.835 0.743 . . . . 0.0 109.776 169.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 43.8 m -65.02 -22.53 67.01 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -169.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.412 ' HG2' HH11 ' A' ' 146' ' ' ARG . 6.1 mtt-85 -68.11 -35.72 78.59 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.978 0.808 . . . . 0.0 111.509 176.595 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.154 0 CA-C-O 117.779 -1.567 . . . . 0.0 110.834 -168.764 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.759 0.314 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -65.44 115.18 5.42 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -53.67 -45.33 70.25 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.466 1.104 . . . . 0.0 108.457 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.42 -27.1 5.83 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 126.519 1.928 . . . . 0.0 113.34 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.52 -28.38 68.36 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.947 0.794 . . . . 0.0 112.539 178.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -93.09 -14.68 26.97 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.03 0.932 . . . . 0.0 113.085 -173.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -102.65 114.43 65.33 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 120.561 1.528 . . . . 0.0 108.589 -173.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.82 -76.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.436 2.757 . . . . 0.0 113.46 -176.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.455 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.7 tp10 -162.52 -68.84 0.05 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.432 1.093 . . . . 0.0 110.957 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -67.32 4.53 0.95 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.923 1.289 . . . . 0.0 112.077 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.455 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -70.51 -8.73 53.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.534 1.934 . . . . 0.0 113.056 -170.742 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.9 mt -120.52 125.5 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -169.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.6 m -145.27 149.58 35.11 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.321 0.581 . . . . 0.0 111.219 -175.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.5 t -126.25 138.49 54.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 170.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.1 mt -139.25 150.45 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 -174.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -70.19 -46.69 64.07 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.699 -0.625 . . . . 0.0 110.282 177.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.1 p -164.15 146.66 9.15 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -76.89 160.98 28.77 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -57.48 -43.39 84.04 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.07 0.548 . . . . 0.0 110.417 173.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -168.35 178.86 4.69 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 127.038 2.135 . . . . 0.0 108.342 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -61.81 -34.33 75.74 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.807 1.643 . . . . 0.0 113.045 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.405 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 53.9 mm-40 -62.03 -50.93 70.03 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.663 1.574 . . . . 0.0 107.834 169.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -60.25 -35.44 75.5 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 121.836 -0.54 . . . . 0.0 111.705 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.1 -31.89 73.14 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.555 0.742 . . . . 0.0 110.751 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -71.16 -46.71 64.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 173.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -56.93 -45.86 82.45 Favored 'General case' 0 C--O 1.226 -0.18 0 O-C-N 121.656 -0.653 . . . . 0.0 110.517 178.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -64.1 -30.33 71.41 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.375 -0.821 . . . . 0.0 111.894 174.612 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 m -67.45 -27.29 66.91 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.587 1.085 . . . . 0.0 112.173 173.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 2.2 mmm -119.79 -13.54 9.09 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.087 1.312 . . . . 0.0 114.425 -169.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.6 p -58.21 -39.13 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 120.792 1.633 . . . . 0.0 112.723 -169.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.0 m -66.11 -22.78 66.41 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.017 0.826 . . . . 0.0 111.908 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.7 mt -82.55 -43.05 17.58 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.061 0.944 . . . . 0.0 108.925 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.82 -49.96 71.83 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.094 0.958 . . . . 0.0 109.737 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.58 -30.6 61.13 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 126.212 1.805 . . . . 0.0 113.947 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.8 mttm -111.27 22.66 14.94 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.35 -175.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 57.74 25.42 11.83 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.463 -0.79 . . . . 0.0 113.054 173.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -69.12 -25.72 64.54 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.279 -0.888 . . . . 0.0 110.368 169.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.3 pt -144.47 176.54 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 125.759 1.623 . . . . 0.0 109.288 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.5 m -116.61 159.1 22.66 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.7 2.0 . . . . 0.0 108.04 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -58.56 -33.44 69.92 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.651 1.114 . . . . 0.0 113.22 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -57.02 -32.23 65.94 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.169 0.587 . . . . 0.0 111.775 175.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -60.23 -45.77 92.09 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.366 0.666 . . . . 0.0 110.421 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.31 -49.32 83.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -69.6 -24.54 63.68 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.219 -177.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.47 -44.42 94.46 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 120.084 1.311 . . . . 0.0 110.488 174.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 56.1 mt -67.04 -47.04 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.5 mttt -58.67 -43.91 90.05 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 117.89 0.314 . . . . 0.0 110.781 -178.075 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -67.41 -39.87 85.54 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 124.272 1.029 . . . . 0.0 110.934 -178.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.6 m -62.14 -40.59 96.45 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.281 0.562 . . . . 0.0 110.223 173.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.4 m -65.35 -36.63 84.59 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.01 0.924 . . . . 0.0 110.917 177.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 72.3 mt -68.17 -41.86 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 119.135 0.879 . . . . 0.0 109.844 172.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -64.37 -37.28 86.96 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.9 0.88 . . . . 0.0 112.433 -170.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.06 -46.11 0.2 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 123.69 0.796 . . . . 0.0 110.828 -168.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.28 173.78 15.1 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 109.444 -1.463 . . . . 0.0 109.444 -175.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_exo -44.52 126.8 7.21 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 123.99 3.127 . . . . 0.0 112.395 172.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -88.74 -11.44 45.05 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.978 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -135.27 98.0 3.86 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -169.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 23.8 mm -141.19 139.13 33.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 mp -132.09 -25.8 1.98 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -170.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.13 161.43 25.85 Favored Pre-proline 0 C--O 1.237 0.401 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 176.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -49.63 116.38 2.31 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.487 2.125 . . . . 0.0 111.005 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.55 4.92 69.84 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.152 -1.36 . . . . 0.0 114.501 177.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.6 t -129.5 122.69 55.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-N 119.33 1.565 . . . . 0.0 108.81 -169.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -121.09 166.03 14.49 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.297 1.439 . . . . 0.0 110.122 177.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 24.7 ttm -136.41 63.88 50.22 Favored Pre-proline 0 CA--C 1.542 0.663 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.73 173.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.52 147.57 22.68 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.18 1.92 . . . . 0.0 113.865 -173.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 174.07 154.92 0.12 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.535 2.334 . . . . 0.0 107.329 -169.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.66 151.7 50.47 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 106.657 -1.609 . . . . 0.0 106.657 169.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -53.6 141.86 43.62 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-O 117.429 -1.272 . . . . 0.0 109.265 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -43.67 -44.46 11.24 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 124.24 3.293 . . . . 0.0 114.645 -170.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -63.73 -9.23 13.18 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.689 1.196 . . . . 0.0 114.023 -177.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 61.7 m -76.63 -1.66 28.8 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.128 0.971 . . . . 0.0 111.867 175.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 129.09 13.48 2.4 Favored Glycine 0 C--N 1.336 0.577 0 CA-C-O 118.185 -1.341 . . . . 0.0 112.985 172.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.4 148.26 52.02 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 119.342 1.571 . . . . 0.0 109.278 170.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 86.2 mt -133.04 -31.05 1.3 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 124.751 1.22 . . . . 0.0 110.975 -173.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -143.91 166.84 23.81 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 126.057 1.743 . . . . 0.0 107.042 178.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.2 m -101.93 125.91 48.71 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 123.17 0.588 . . . . 0.0 109.734 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -174.28 175.76 46.67 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.714 1.149 . . . . 0.0 111.276 -177.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 56.8 mtt -140.72 167.71 21.53 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.803 1.241 . . . . 0.0 112.246 -170.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 p -144.25 165.33 28.18 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.136 1.774 . . . . 0.0 109.377 178.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.0 tp -146.92 110.81 5.01 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.191 1.797 . . . . 0.0 107.861 -169.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 31.5 m -127.02 139.35 53.08 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -171.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 12.1 tp -135.22 145.35 47.56 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 174.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -125.01 112.35 16.46 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 126.161 1.785 . . . . 0.0 106.193 -173.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -59.83 -24.79 64.47 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -116.79 -5.32 11.56 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.192 0.997 . . . . 0.0 112.088 -177.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.95 168.58 4.43 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.628 1.109 . . . . 0.0 113.49 -173.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 16.3 t -139.11 148.99 23.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 105.137 -2.172 . . . . 0.0 105.137 174.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -116.42 100.62 8.0 Favored 'General case' 0 C--N 1.334 -0.093 0 O-C-N 121.762 -0.586 . . . . 0.0 110.712 -168.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -59.11 150.99 59.41 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.679 173.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -75.62 -0.58 10.32 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.455 2.77 . . . . 0.0 115.119 -172.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -149.05 35.78 1.06 Allowed Glycine 0 CA--C 1.526 0.735 0 CA-C-N 119.659 1.118 . . . . 0.0 113.02 -171.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -131.82 161.11 33.73 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 118.029 0.914 . . . . 0.0 108.559 172.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -72.91 -21.79 60.84 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -171.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -149.51 164.86 19.23 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.105 0.962 . . . . 0.0 111.699 -176.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -74.39 150.26 41.05 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.835 2.356 . . . . 0.0 110.714 177.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 40.7 mm -99.53 136.91 28.71 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 -177.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -109.72 -14.24 14.36 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 117.161 -1.4 . . . . 0.0 111.096 172.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 37.3 tp -144.11 131.9 21.36 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 120.603 1.547 . . . . 0.0 110.319 -169.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mp -138.71 117.2 12.07 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 -174.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.4 mp -98.39 111.02 27.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 105.141 -2.17 . . . . 0.0 105.141 173.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.07 151.39 36.91 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 174.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -143.26 142.93 31.53 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 105.408 -2.071 . . . . 0.0 105.408 172.05 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.4 p -135.68 144.24 45.87 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 127.248 2.219 . . . . 0.0 106.498 169.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.8 135.94 22.57 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -175.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -77.98 -22.41 49.43 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.723 0.409 . . . . 0.0 111.803 -177.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -144.05 155.67 44.08 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.011 0.924 . . . . 0.0 110.019 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.09 -34.99 74.23 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -177.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -75.97 -32.11 59.33 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.865 -1.147 . . . . 0.0 110.937 177.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.9 m -62.51 -41.12 98.61 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 169.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 23.4 t60 -58.27 -49.93 75.4 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.027 0.931 . . . . 0.0 110.038 173.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.6 mm -55.94 -54.19 29.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 118.875 0.761 . . . . 0.0 109.568 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.06 -38.77 94.79 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.669 0.668 . . . . 0.0 111.702 -176.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.56 -48.49 60.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.466 1.107 . . . . 0.0 111.1 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.32 -43.55 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 124.489 1.115 . . . . 0.0 108.758 176.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -70.47 -11.11 60.71 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.716 0.806 . . . . 0.0 111.991 -178.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.88 -45.32 12.37 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 169.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.8 mt -71.13 -30.29 66.31 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.742 -0.599 . . . . 0.0 112.042 -173.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.1 m -61.44 -21.1 63.83 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 122.98 0.512 . . . . 0.0 112.076 172.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -68.7 -28.18 66.61 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.608 1.094 . . . . 0.0 110.0 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 40.0 mt -96.66 -63.6 1.12 Allowed 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.0 0.92 . . . . 0.0 111.037 -178.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 17.2 mt -73.38 -1.13 16.9 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -169.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 55.6 m -112.04 27.83 9.3 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.529 1.059 . . . . 0.0 111.357 174.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -141.33 97.66 3.21 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -171.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.87 -26.16 58.15 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.658 0.783 . . . . 0.0 112.371 -173.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -63.43 -46.3 86.95 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.224 0.535 . . . . 0.0 109.79 176.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.54 -43.79 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 C-N-CA 124.427 1.091 . . . . 0.0 109.134 176.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 46.8 mt -56.52 -44.58 80.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 118.945 -0.55 . . . . 0.0 110.976 -173.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -67.04 -38.54 86.07 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 118.152 0.433 . . . . 0.0 110.367 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -67.64 -35.86 79.69 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 118.723 0.692 . . . . 0.0 109.696 -177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 26.2 mt -70.06 -51.98 27.62 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 173.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 57.4 mt -60.54 -12.03 8.75 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 80.7 p -120.39 8.09 10.75 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.844 1.258 . . . . 0.0 111.321 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.49 114.67 3.08 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.591 1.156 . . . . 0.0 109.782 177.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.8 m -75.5 -20.26 58.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.857 0.863 . . . . 0.0 111.865 178.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.3 m -147.79 157.55 43.59 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.976 0.91 . . . . 0.0 109.939 -169.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -61.01 -38.62 86.72 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.434 1.093 . . . . 0.0 110.522 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -58.61 -36.63 74.32 Favored 'General case' 0 C--O 1.226 -0.178 0 O-C-N 121.946 -0.471 . . . . 0.0 111.389 175.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -68.87 -34.14 74.94 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 123.727 0.811 . . . . 0.0 112.074 177.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 58.6 mt -67.28 -45.46 76.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.733 1.151 . . . . 0.0 107.954 172.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -64.65 -27.08 68.68 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -61.55 -38.84 88.94 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 120.776 -1.203 . . . . 0.0 109.914 174.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 80.1 mt -72.37 -34.99 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 124.514 1.125 . . . . 0.0 109.221 -179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 36.3 mm -56.45 -51.76 60.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 169.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.6 m -65.57 -29.59 70.22 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.987 -170.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -61.51 -30.15 70.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.495 1.918 . . . . 0.0 112.569 172.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.006 0 CA-C-O 117.931 -1.483 . . . . 0.0 110.435 -172.357 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 ttt . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.14 112.78 1.3 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.889 0.376 . . . . 0.0 111.792 171.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.2 -34.38 68.46 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 123.359 0.664 . . . . 0.0 109.876 169.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -59.9 -12.29 7.37 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.189 1.396 . . . . 0.0 113.166 176.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -87.09 -32.22 20.05 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.618 1.099 . . . . 0.0 112.957 171.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -86.35 -43.81 12.58 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 122.794 0.438 . . . . 0.0 110.413 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -86.66 119.25 71.2 Favored Pre-proline 0 CA--C 1.551 1.013 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 -178.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -82.66 -97.72 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.866 3.044 . . . . 0.0 112.225 -169.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -151.66 163.27 39.48 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.836 2.054 . . . . 0.0 106.756 173.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m 57.37 14.51 2.21 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.7 1.6 . . . . 0.0 112.226 -169.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.2 p -103.27 19.99 18.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.535 2.334 . . . . 0.0 112.354 -168.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.8 mt -133.74 141.35 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 169.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.8 m -156.93 149.45 23.34 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 169.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.7 t -113.48 133.56 59.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 103.793 -2.669 . . . . 0.0 103.793 169.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.2 mt -131.67 147.68 32.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -169.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.417 ' C ' ' HG ' ' A' ' 17' ' ' SER . 72.9 t60 -67.81 -44.64 76.82 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.814 -0.554 . . . . 0.0 110.604 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.417 ' HG ' ' C ' ' A' ' 16' ' ' HIS . 4.7 m -165.47 148.55 7.95 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 -176.136 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.71 148.56 34.88 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 171.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.34 -37.48 83.47 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.109 0.564 . . . . 0.0 110.703 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -164.05 -179.21 6.06 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 127.078 2.151 . . . . 0.0 106.805 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 39.4 p-90 -66.48 -33.81 76.52 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 121.584 -0.698 . . . . 0.0 111.812 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.453 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 49.2 mt-30 -54.52 -51.08 66.29 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 169.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.37 -31.78 72.77 Favored 'General case' 0 C--O 1.222 -0.382 0 O-C-N 121.842 -0.536 . . . . 0.0 111.411 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.8 87.55 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 121.853 -0.529 . . . . 0.0 109.812 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.4 -45.68 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -57.92 -45.59 86.31 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.981 0.512 . . . . 0.0 110.423 -174.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -66.68 -32.26 73.46 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.778 -1.106 . . . . 0.0 111.815 173.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.3 m -61.42 -24.89 66.84 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 120.023 1.283 . . . . 0.0 111.675 173.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 9.3 mmt -120.13 -19.81 7.62 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -169.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.8 p -61.03 -34.15 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 CA-C-N 121.571 1.987 . . . . 0.0 112.212 -171.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.4 m -64.78 -30.11 71.11 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.245 0.929 . . . . 0.0 111.354 178.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.2 mt -74.57 -44.26 51.74 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.97 0.908 . . . . 0.0 108.584 172.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.4 tp -56.76 -40.17 75.34 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.881 0.872 . . . . 0.0 110.96 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -66.64 -30.59 70.89 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.116 1.367 . . . . 0.0 113.049 -173.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -98.81 14.71 27.86 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.001 0.364 . . . . 0.0 110.764 172.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.454 0.0 OUTLIER 44.9 43.62 7.22 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.183 2.193 . . . . 0.0 115.357 -169.636 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.424 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 30.6 m-85 -66.44 -19.75 65.88 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.509 -0.745 . . . . 0.0 109.489 168.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.1 pt -143.91 171.2 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 127.152 2.181 . . . . 0.0 108.585 -176.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.0 m -103.78 159.22 15.82 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.065 1.746 . . . . 0.0 107.52 169.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -59.87 -32.44 70.71 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.113 -0.992 . . . . 0.0 111.623 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -57.51 -34.96 69.65 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.12 0.568 . . . . 0.0 112.0 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -59.78 -40.84 89.61 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.72 0.808 . . . . 0.0 110.643 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.2 mt -63.73 -49.88 80.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.426 1.09 . . . . 0.0 108.599 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -66.14 -28.5 68.84 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 118.59 -0.719 . . . . 0.0 112.479 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.19 -43.16 78.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 118.82 0.736 . . . . 0.0 110.684 173.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 52.2 mt -69.26 -47.16 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.453 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.6 mttt -62.43 -43.87 97.78 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.373 0.533 . . . . 0.0 111.051 -173.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -66.61 -40.85 89.03 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.237 1.015 . . . . 0.0 110.757 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.404 ' HB3' ' CE1' ' A' ' 56' ' ' TYR . 18.3 m -63.98 -34.5 78.12 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.938 -0.476 . . . . 0.0 110.415 174.208 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 92.3 m -65.13 -39.77 93.51 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.752 0.821 . . . . 0.0 110.805 175.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.9 mt -63.48 -43.96 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 119.35 0.977 . . . . 0.0 109.82 171.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -66.26 -32.93 74.65 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -169.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -145.4 -53.8 0.29 Allowed 'General case' 0 C--O 1.231 0.123 0 O-C-N 123.251 0.344 . . . . 0.0 111.857 -168.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 158.42 170.15 22.75 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -178.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -56.42 133.06 55.67 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.841 2.361 . . . . 0.0 112.857 -170.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.404 ' CE1' ' HB3' ' A' ' 49' ' ' SER . 7.6 m-85 -86.99 85.88 7.28 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 113.97 -1.468 . . . . 0.0 107.391 -176.514 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 110.44 106.09 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 131.43 3.892 . . . . 0.0 111.163 168.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.1 mm -127.13 137.29 58.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 172.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -121.54 -31.17 4.08 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.309 0.644 . . . . 0.0 111.55 -170.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.56 160.1 27.95 Favored Pre-proline 0 C--O 1.236 0.343 0 C-N-CA 125.443 1.497 . . . . 0.0 107.046 176.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -50.92 113.31 1.03 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.53 2.153 . . . . 0.0 109.66 169.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 101.52 -6.19 55.2 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-O 117.528 -1.707 . . . . 0.0 114.538 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.4 t -130.45 127.49 62.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 120.036 1.918 . . . . 0.0 110.051 -169.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.62 166.33 16.91 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 126.214 1.805 . . . . 0.0 109.899 176.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.0 ttm -140.53 60.33 13.64 Favored Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 176.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 141.0 59.21 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.824 1.683 . . . . 0.0 113.755 -171.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -177.02 153.88 1.03 Allowed 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 128.537 2.735 . . . . 0.0 106.176 -170.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.82 160.52 38.3 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 126.41 1.884 . . . . 0.0 107.46 172.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.3 mtm105 -55.32 143.89 53.92 Favored Pre-proline 0 CA--C 1.535 0.398 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.838 177.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -45.94 -41.36 20.56 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.721 2.947 . . . . 0.0 113.335 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -61.77 -13.53 24.39 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.052 1.341 . . . . 0.0 113.288 -176.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 62.6 m -76.3 -3.99 39.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.463 0.705 . . . . 0.0 111.785 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.92 18.19 2.16 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.236 -1.313 . . . . 0.0 112.941 175.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.55 147.1 53.97 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 119.529 1.665 . . . . 0.0 109.107 169.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.4 mt -129.71 -29.74 2.12 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.356 1.062 . . . . 0.0 111.045 -173.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.424 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 87.9 mttt -143.58 157.78 44.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 125.707 1.603 . . . . 0.0 107.739 175.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.7 m -88.84 126.09 35.21 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.79 -178.4 39.79 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.019 0.819 . . . . 0.0 111.793 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 50.2 mtp -143.77 169.22 18.18 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 125.37 1.468 . . . . 0.0 111.132 -176.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.1 m -155.61 162.96 40.53 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.861 1.264 . . . . 0.0 109.444 169.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 mp -124.92 136.45 53.78 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 128.108 2.563 . . . . 0.0 107.141 -177.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 88.0 m -134.28 136.29 43.45 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 175.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.2 tp -129.06 144.59 51.24 Favored 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 123.346 0.404 . . . . 0.0 110.248 171.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -114.24 143.48 44.77 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.139 1.375 . . . . 0.0 109.735 174.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -74.95 -33.31 61.92 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 168.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -125.43 94.91 4.28 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.567 1.947 . . . . 0.0 107.324 174.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -56.81 162.35 7.06 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.188 0.899 . . . . 0.0 112.589 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 92.7 t -130.78 145.99 34.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 -173.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -105.21 172.27 6.88 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.733 0.813 . . . . 0.0 109.374 -174.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -124.19 157.18 65.08 Favored Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 124.718 1.207 . . . . 0.0 113.202 -169.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -63.12 -4.89 6.93 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.668 2.912 . . . . 0.0 115.441 -176.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -135.8 16.61 3.99 Favored Glycine 0 CA--C 1.532 1.151 0 CA-C-N 119.418 1.008 . . . . 0.0 113.238 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -153.94 109.74 3.23 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 119.199 1.499 . . . . 0.0 107.856 172.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -73.8 -22.28 59.86 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -171.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.4 tp10 -76.44 127.02 85.54 Favored Pre-proline 0 N--CA 1.437 -1.123 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -71.8 149.84 54.82 Favored 'Trans proline' 0 N--CA 1.449 -1.137 0 C-N-CA 122.257 1.971 . . . . 0.0 110.58 -179.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 39.9 mm -105.36 123.85 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -91.08 -22.63 20.63 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.291 -1.337 . . . . 0.0 111.043 170.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 40.7 tp -132.07 128.7 38.77 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.293 1.406 . . . . 0.0 110.649 -169.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.4 mp -132.02 138.05 48.07 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -178.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 6.0 mt -123.43 107.53 19.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -71.23 147.99 43.47 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 174.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -144.57 135.45 24.93 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 169.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.9 p -129.4 148.28 51.3 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 125.751 1.62 . . . . 0.0 106.793 168.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.84 133.24 21.85 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 118.88 0.764 . . . . 0.0 109.568 -177.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.71 -20.09 61.28 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.892 0.477 . . . . 0.0 111.878 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -147.58 152.62 38.25 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.381 1.072 . . . . 0.0 109.364 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.86 -32.87 71.09 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -175.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -77.9 -30.45 50.7 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 119.416 1.007 . . . . 0.0 111.32 178.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 7.9 m -64.76 -37.17 86.7 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.739 -0.6 . . . . 0.0 109.983 169.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -47.07 86.55 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 124.063 0.945 . . . . 0.0 110.185 170.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.5 mm -58.37 -49.45 81.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -57.39 -41.68 93.31 Favored Glycine 0 CA--C 1.532 1.103 0 CA-C-N 118.97 0.805 . . . . 0.0 111.924 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.28 -45.67 65.86 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.524 0.73 . . . . 0.0 111.213 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.0 mm -55.08 -46.71 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 124.86 1.264 . . . . 0.0 108.02 174.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -68.41 -9.87 51.35 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.422 1.089 . . . . 0.0 112.348 -177.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -95.95 -43.22 7.91 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 124.593 1.157 . . . . 0.0 110.834 171.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 4.4 pp -76.05 -26.62 56.73 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 118.376 0.534 . . . . 0.0 111.407 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.6 p -59.4 -21.98 60.73 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.089 173.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -65.61 -20.4 66.3 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.137 0.881 . . . . 0.0 110.182 172.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 23.1 mt -102.2 -60.86 1.47 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.319 1.447 . . . . 0.0 111.037 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.79 -31.9 68.83 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.986 1.314 . . . . 0.0 113.802 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 59.6 m -104.58 26.74 8.67 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 118.641 0.655 . . . . 0.0 110.74 -174.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -132.29 97.9 4.25 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.0 -28.11 55.77 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.572 0.749 . . . . 0.0 112.263 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -65.61 -44.02 87.85 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.07 0.548 . . . . 0.0 110.142 176.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.64 -42.54 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 123.595 0.758 . . . . 0.0 108.998 175.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 62.2 mt -55.24 -43.87 74.98 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-O 118.711 -0.662 . . . . 0.0 110.595 -177.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -65.96 -40.8 91.62 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 118.605 0.639 . . . . 0.0 110.787 178.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -69.97 -29.0 66.0 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.504 0.593 . . . . 0.0 110.877 -175.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 34.5 mt -75.77 -52.73 9.78 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.942 0.897 . . . . 0.0 109.195 169.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 38.5 mt -57.61 -20.66 34.35 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.97 0.908 . . . . 0.0 113.294 -176.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 76.4 p -114.25 10.85 17.3 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.679 1.192 . . . . 0.0 111.249 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.98 110.92 1.48 Allowed 'General case' 0 C--N 1.344 0.35 0 C-N-CA 124.167 0.987 . . . . 0.0 110.287 -179.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 10.5 m -74.67 -10.84 59.91 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.567 0.747 . . . . 0.0 112.157 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 3.6 p -158.1 152.64 24.72 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.997 0.817 . . . . 0.0 108.997 -172.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -59.26 -34.96 72.87 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.634 1.174 . . . . 0.0 110.774 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -35.21 60.15 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 124.561 1.144 . . . . 0.0 113.819 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -73.14 -34.92 66.38 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 123.447 0.699 . . . . 0.0 110.173 -177.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 mp -61.9 -46.31 89.93 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-N 119.978 1.263 . . . . 0.0 109.019 172.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.71 -29.93 71.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.479 0.712 . . . . 0.0 112.637 177.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -68.63 -44.85 73.35 Favored 'General case' 0 C--N 1.332 -0.163 0 O-C-N 121.169 -0.957 . . . . 0.0 110.421 174.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 68.8 mt -62.34 -38.58 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 C-N-CA 124.229 1.011 . . . . 0.0 109.884 177.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 12.7 mm -55.79 -56.15 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.062 0 C-N-CA 123.722 0.809 . . . . 0.0 109.289 169.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 40.7 m -64.36 -26.46 68.48 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.887 0.475 . . . . 0.0 111.279 -170.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -58.94 -27.88 65.72 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.836 1.654 . . . . 0.0 113.362 173.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.936 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 -173.957 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.2 tpp . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.96 114.52 3.12 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 168.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -56.92 -43.57 81.55 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.978 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.97 -26.37 14.99 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.407 1.483 . . . . 0.0 112.955 -176.749 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -59.43 -28.55 67.05 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 118.888 0.767 . . . . 0.0 111.971 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -91.21 -12.56 34.94 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 117.545 -1.217 . . . . 0.0 112.859 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -114.02 85.66 10.35 Favored Pre-proline 0 N--CA 1.473 0.703 0 CA-C-N 121.607 2.003 . . . . 0.0 107.832 -173.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -57.92 -53.64 4.15 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.224 2.616 . . . . 0.0 116.412 -169.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.552 ' C ' ' H ' ' A' ' 11' ' ' SER . 41.6 tt0 -159.64 -88.3 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.041 0.837 . . . . 0.0 113.191 -169.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.9 m -68.77 16.23 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.884 1.674 . . . . 0.0 111.162 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.552 ' H ' ' C ' ' A' ' 9' ' ' GLU . 8.7 m -76.92 10.08 2.51 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 128.174 2.589 . . . . 0.0 112.785 -168.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.6 mm -139.4 130.11 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 N-CA-C 104.071 -2.566 . . . . 0.0 104.071 -171.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.6 m -157.24 136.39 11.86 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 119.625 1.102 . . . . 0.0 110.621 171.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.6 p -106.03 139.66 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 168.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.8 mt -135.89 143.86 35.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 124.255 1.022 . . . . 0.0 108.315 -168.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 39.6 m80 -67.95 -35.22 78.02 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.925 0.49 . . . . 0.0 111.959 177.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -174.42 144.23 0.89 Allowed 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.201 1.8 . . . . 0.0 106.431 176.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.3 150.24 30.04 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 169.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -59.41 -41.29 89.16 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.127 0.571 . . . . 0.0 110.977 -178.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -167.16 -176.24 3.25 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 126.531 1.933 . . . . 0.0 108.052 172.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 24.1 p-90 -68.69 -30.73 69.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.897 0.771 . . . . 0.0 112.817 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.471 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.0 mt-30 -60.83 -47.51 86.01 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 171.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.87 -35.71 79.12 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 121.201 -0.937 . . . . 0.0 111.666 176.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.0 -34.07 77.17 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.881 -0.512 . . . . 0.0 110.65 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.72 -46.52 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 171.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -56.46 -46.59 80.3 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 118.227 0.467 . . . . 0.0 110.331 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -62.98 -34.34 77.33 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 117.98 -1.01 . . . . 0.0 111.561 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.2 m -63.85 -21.72 66.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.937 1.244 . . . . 0.0 112.484 174.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.0 mmt -123.51 -17.58 6.44 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -169.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -58.25 -35.4 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 120.3 1.409 . . . . 0.0 112.399 -169.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 m -60.48 -36.19 77.7 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 119.217 0.917 . . . . 0.0 110.819 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.6 mt -78.62 -40.44 34.33 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.152 0.981 . . . . 0.0 109.199 178.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 43.0 tp -56.99 -40.97 77.55 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.337 0.517 . . . . 0.0 110.24 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -68.11 -32.44 72.75 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 124.733 1.213 . . . . 0.0 113.252 -172.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -96.68 17.89 15.49 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.31 0.505 . . . . 0.0 110.672 172.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.43 0.0 OUTLIER 44.18 40.85 3.83 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.579 2.351 . . . . 0.0 115.979 -171.27 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -66.71 -20.4 65.96 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.195 -0.941 . . . . 0.0 109.372 167.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.7 pt -143.57 168.87 11.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 C-N-CA 126.928 2.091 . . . . 0.0 108.419 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 64.4 p -101.13 165.88 11.07 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.831 1.252 . . . . 0.0 108.889 169.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.4 -30.29 70.46 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.266 -0.897 . . . . 0.0 111.86 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -59.46 -33.68 71.59 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 121.931 -0.481 . . . . 0.0 111.604 177.161 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -59.84 -41.68 91.92 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.344 0.658 . . . . 0.0 111.199 -177.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.6 mp -59.26 -49.51 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -67.36 -29.17 68.64 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 121.61 -0.681 . . . . 0.0 112.757 -178.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.11 -43.48 78.19 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.688 0.676 . . . . 0.0 110.907 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 51.1 mt -69.36 -44.75 80.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 178.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.471 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.8 mttt -63.22 -41.08 99.08 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.611 -0.681 . . . . 0.0 111.077 -176.197 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.16 -39.61 94.36 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.316 1.046 . . . . 0.0 110.623 176.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.0 m -62.59 -36.86 84.05 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.996 -0.44 . . . . 0.0 110.539 172.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 23.9 m -67.83 -38.84 83.72 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.479 0.712 . . . . 0.0 110.39 177.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 79.9 mt -63.69 -41.5 92.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-N 118.901 0.773 . . . . 0.0 110.027 172.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -65.9 -35.2 79.96 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.304 0.642 . . . . 0.0 112.483 -171.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -149.88 -49.26 0.14 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 122.85 0.46 . . . . 0.0 111.759 -168.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 150.31 179.9 26.49 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 109.134 -1.586 . . . . 0.0 109.134 -173.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -61.81 123.4 12.58 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.573 2.182 . . . . 0.0 108.697 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -78.93 -13.64 59.68 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.102 -172.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -134.21 99.36 4.37 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.197 0.999 . . . . 0.0 108.383 -169.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.6 mm -133.16 140.38 47.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -114.84 -31.62 6.06 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.025 0.53 . . . . 0.0 111.164 175.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -156.45 158.56 31.5 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 125.469 1.508 . . . . 0.0 107.376 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.12 124.09 9.76 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.473 2.115 . . . . 0.0 110.104 169.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.66 -0.08 88.01 Favored Glycine 0 CA--C 1.537 1.417 0 CA-C-O 117.791 -1.561 . . . . 0.0 115.077 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.3 t -127.78 111.08 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 119.986 1.893 . . . . 0.0 108.033 -176.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -107.74 167.65 9.82 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 123.881 0.872 . . . . 0.0 110.027 174.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.4 ttm -141.05 61.58 14.68 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 176.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -52.17 143.04 43.57 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 121.901 1.734 . . . . 0.0 113.902 -171.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -178.4 154.33 0.8 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 128.472 2.709 . . . . 0.0 106.388 -170.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -136.65 153.28 50.96 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.961 1.704 . . . . 0.0 107.621 169.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 38.2 mtm105 -53.56 143.16 38.81 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.33 -178.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -45.5 -43.17 18.05 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.901 3.067 . . . . 0.0 114.145 -171.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.2 -13.53 18.81 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.687 1.195 . . . . 0.0 113.975 -177.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.1 m -75.88 -7.15 53.85 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.774 0.83 . . . . 0.0 111.954 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 135.75 14.21 1.03 Allowed Glycine 0 CA--C 1.525 0.705 0 CA-C-O 118.434 -1.203 . . . . 0.0 113.547 177.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.87 144.79 52.41 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 119.904 1.852 . . . . 0.0 109.304 169.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.5 mt -129.68 -32.71 1.89 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 124.854 1.261 . . . . 0.0 110.479 -173.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -143.39 164.76 29.38 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 126.149 1.78 . . . . 0.0 107.968 174.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.6 m -97.07 130.94 44.3 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 123.218 0.607 . . . . 0.0 110.587 -178.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.46 -179.07 45.77 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 124.954 1.264 . . . . 0.0 110.737 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 47.1 mtt -143.9 171.09 14.71 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 126.46 1.904 . . . . 0.0 110.706 -175.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.85 161.7 41.3 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 126.427 1.891 . . . . 0.0 107.872 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.3 tp -141.54 117.56 10.57 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.336 1.855 . . . . 0.0 107.274 -172.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 69.6 m -123.37 141.72 51.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.9 tp -133.25 146.35 51.34 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 171.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.17 135.61 53.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.368 1.067 . . . . 0.0 108.573 174.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.05 -40.55 87.14 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 168.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -123.06 94.01 4.13 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.758 2.023 . . . . 0.0 106.825 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -53.93 160.98 4.02 Favored Glycine 0 CA--C 1.526 0.754 0 C-N-CA 124.885 1.231 . . . . 0.0 113.491 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.0 t -123.73 149.87 27.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 -179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -112.21 108.64 17.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.079 0.466 . . . . 0.0 111.832 -167.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -63.84 152.46 86.81 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 169.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -74.46 49.68 2.14 Favored 'Trans proline' 0 CA--C 1.549 1.253 0 C-N-CA 123.918 3.079 . . . . 0.0 113.044 176.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 174.67 51.23 0.05 OUTLIER Glycine 0 CA--C 1.529 0.93 0 O-C-N 120.762 -1.211 . . . . 0.0 113.748 177.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -137.45 172.31 13.17 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.626 1.213 . . . . 0.0 110.198 169.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -73.88 -31.93 63.36 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.143 -0.348 . . . . 0.0 111.607 173.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -151.16 167.07 13.7 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 124.306 1.042 . . . . 0.0 111.97 -176.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -53.9 134.06 57.56 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.396 2.731 . . . . 0.0 111.809 174.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 26.4 mm -72.79 128.55 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 175.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -104.74 -15.38 15.25 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 117.239 -1.363 . . . . 0.0 111.134 170.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 48.9 tp -141.1 132.11 26.16 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 120.467 1.485 . . . . 0.0 109.645 -171.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.8 mp -137.47 132.43 33.32 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 3.0 mt -112.94 117.21 54.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 168.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.51 147.41 35.62 Favored Glycine 0 N--CA 1.443 -0.852 0 N-CA-C 108.465 -1.854 . . . . 0.0 108.465 169.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -141.95 138.65 32.11 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 103.277 -2.86 . . . . 0.0 103.277 169.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 5.2 m -140.71 143.99 35.34 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 169.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.23 136.96 26.98 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 118.399 0.545 . . . . 0.0 109.734 -169.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.92 -22.05 59.82 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.03 0.532 . . . . 0.0 112.097 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -146.31 155.54 42.71 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.973 0.909 . . . . 0.0 109.758 -178.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.43 74.29 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -177.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.59 -31.58 62.08 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 120.807 -1.183 . . . . 0.0 110.946 177.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.7 m -64.49 -39.33 93.6 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.993 -0.442 . . . . 0.0 110.161 170.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.9 t60 -58.8 -48.84 79.87 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 123.541 0.737 . . . . 0.0 110.054 171.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 12.2 mm -56.01 -53.02 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.472 0.709 . . . . 0.0 109.168 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.24 -39.35 94.47 Favored Glycine 0 CA--C 1.529 0.966 0 CA-C-N 118.931 0.787 . . . . 0.0 111.929 -177.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.84 -53.48 21.18 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.506 1.122 . . . . 0.0 110.64 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.3 mm -49.89 -47.54 22.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 125.746 1.619 . . . . 0.0 108.883 173.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -67.72 -10.95 57.02 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.427 -0.795 . . . . 0.0 112.384 -177.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.35 -48.33 6.72 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.146 0.979 . . . . 0.0 109.509 170.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 1.9 pp -70.33 -22.73 62.77 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -176.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 44.2 m -63.18 -23.24 67.34 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 123.522 0.729 . . . . 0.0 111.475 173.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -66.84 -17.45 64.89 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.522 -0.736 . . . . 0.0 110.122 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 38.0 mt -108.1 -61.87 1.52 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.822 1.249 . . . . 0.0 110.951 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 72.8 mt -69.63 -8.62 49.14 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.21 1.404 . . . . 0.0 114.206 -173.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.1 m -120.09 27.68 8.51 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.843 0.857 . . . . 0.0 110.64 175.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -131.44 101.62 5.6 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 125.316 1.446 . . . . 0.0 107.515 176.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -56.8 -27.62 60.13 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.657 0.783 . . . . 0.0 112.217 -177.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -63.13 -48.53 78.12 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 123.465 0.706 . . . . 0.0 109.789 176.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.28 -43.26 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 C-N-CA 123.945 0.898 . . . . 0.0 109.016 177.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 47.5 mt -55.73 -43.2 76.34 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.989 -175.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -66.99 -38.9 86.87 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.479 0.581 . . . . 0.0 110.711 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -70.97 -34.7 71.68 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 118.78 0.718 . . . . 0.0 109.863 -175.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 35.1 mt -67.91 -54.35 19.49 Favored 'General case' 0 C--O 1.224 -0.27 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 170.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.5 mt -56.57 -23.61 41.59 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -175.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 69.6 p -109.45 5.62 23.51 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.434 1.093 . . . . 0.0 111.876 -178.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.03 106.33 0.82 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 124.271 1.028 . . . . 0.0 110.68 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.5 p -75.55 -1.86 26.38 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.033 1.333 . . . . 0.0 112.999 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 21.4 p -149.78 155.4 40.05 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.04 0.936 . . . . 0.0 110.714 -177.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -58.62 -39.28 80.03 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.506 1.122 . . . . 0.0 109.577 173.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -34.26 74.93 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.06 -178.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -63.17 -44.14 96.3 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.603 0.638 . . . . 0.0 110.941 174.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.6 mt -63.54 -49.07 74.9 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.56 -35.13 71.87 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 173.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -66.74 -43.09 85.11 Favored 'General case' 0 C--N 1.331 -0.197 0 O-C-N 120.962 -1.086 . . . . 0.0 109.86 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 82.9 mt -66.75 -35.16 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 C-N-CA 123.661 0.784 . . . . 0.0 109.199 179.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.1 mm -58.54 -53.14 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 169.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 25.3 m -63.0 -28.76 70.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 122.747 0.419 . . . . 0.0 111.61 -171.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -60.01 -28.28 67.59 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 126.212 1.805 . . . . 0.0 113.565 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.869 0 CA-C-O 117.935 -1.481 . . . . 0.0 109.5 -173.245 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.222 0.058 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -66.21 110.21 2.93 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 173.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -59.46 -32.63 70.41 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 171.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.58 -18.47 11.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.103 0.961 . . . . 0.0 112.443 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -66.09 -22.45 66.4 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 118.883 0.765 . . . . 0.0 112.772 176.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -102.76 -4.85 24.38 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 117.039 -1.458 . . . . 0.0 114.215 -169.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -116.16 88.07 21.43 Favored Pre-proline 0 N--CA 1.475 0.815 0 CA-C-N 122.116 2.234 . . . . 0.0 109.245 -170.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_exo -40.65 -73.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.808 1 C-N-CA 125.723 4.282 . . . . 0.0 116.448 -174.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.482 ' C ' ' H ' ' A' ' 11' ' ' SER . 37.2 tt0 -163.32 -76.72 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.832 0.853 . . . . 0.0 111.252 -171.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.67 6.8 0.58 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.774 1.63 . . . . 0.0 111.914 175.336 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.482 ' H ' ' C ' ' A' ' 9' ' ' GLU . 3.5 m -73.94 -0.85 17.43 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.571 2.348 . . . . 0.0 113.626 -168.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.6 mt -133.48 134.5 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 -169.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.7 m -156.41 151.71 26.62 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.496 0.718 . . . . 0.0 110.939 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.9 t -118.74 142.22 34.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 169.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.41 HG22 ' H ' ' A' ' 17' ' ' SER . 15.3 mt -139.41 147.69 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.227 1.811 . . . . 0.0 106.216 -171.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -68.65 -45.54 71.5 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.231 -0.918 . . . . 0.0 110.375 169.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -170.6 145.95 2.63 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.918 1.687 . . . . 0.0 106.455 -177.861 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.29 159.22 27.32 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 174.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt -59.09 -35.7 73.86 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.404 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -164.6 -179.28 5.84 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 127.328 2.251 . . . . 0.0 106.8 170.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 41.8 p-90 -64.97 -33.78 76.86 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.209 -0.932 . . . . 0.0 112.194 171.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.42 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 48.8 mt-30 -55.27 -45.23 76.15 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.75 1.22 . . . . 0.0 108.485 170.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -71.04 -33.56 70.41 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 121.23 -0.919 . . . . 0.0 110.817 177.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.42 -35.08 79.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 121.573 -0.704 . . . . 0.0 110.786 -178.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.94 -47.07 86.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 170.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.46 -42.24 82.13 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 118.469 0.577 . . . . 0.0 110.604 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -64.68 -33.1 75.16 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.167 0.987 . . . . 0.0 111.614 173.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.9 m -67.16 -17.97 65.07 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.831 1.196 . . . . 0.0 112.03 173.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.1 mmt -125.57 -23.48 4.06 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -168.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 p -60.25 -36.91 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 120.837 1.653 . . . . 0.0 111.684 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.0 m -67.16 -19.54 65.61 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 118.594 0.634 . . . . 0.0 112.119 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 79.9 mt -86.33 -43.46 12.86 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.908 0.883 . . . . 0.0 109.115 169.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 35.8 tp -56.61 -43.2 79.94 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.92 0.888 . . . . 0.0 110.66 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -67.65 -23.49 65.34 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 125.865 1.666 . . . . 0.0 113.931 -171.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -114.49 26.1 10.5 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.057 0.389 . . . . 0.0 110.592 171.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 60.82 26.38 16.22 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 170.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -66.97 -23.05 65.9 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.165 -0.959 . . . . 0.0 110.647 169.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.5 pt -142.06 179.61 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 126.702 2.001 . . . . 0.0 107.975 178.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.8 p -123.17 162.65 22.13 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.816 1.646 . . . . 0.0 108.727 170.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.05 -31.68 67.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.06 0.944 . . . . 0.0 113.076 -169.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -60.16 -33.5 72.27 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.746 -0.596 . . . . 0.0 111.794 177.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -59.48 -41.51 89.97 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.722 0.809 . . . . 0.0 110.647 -177.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.12 -52.09 64.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 123.446 0.699 . . . . 0.0 109.552 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -68.9 -26.84 65.3 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -176.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.71 -41.37 73.71 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.024 0.829 . . . . 0.0 111.03 173.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 33.5 mt -70.29 -45.65 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.42 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.5 mttt -66.64 -39.9 88.47 Favored 'General case' 0 C--O 1.224 -0.266 0 O-C-N 121.989 -0.444 . . . . 0.0 111.445 -175.528 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.45 -41.43 98.73 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.24 1.016 . . . . 0.0 110.301 178.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -64.83 -40.85 95.84 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.411 0.684 . . . . 0.0 110.508 173.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 27.8 m -60.07 -40.26 88.9 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.606 -0.684 . . . . 0.0 111.2 174.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 64.1 mt -68.88 -48.02 72.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 119.324 0.966 . . . . 0.0 110.009 176.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -74.64 -32.69 62.36 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -169.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -130.25 -52.45 1.11 Allowed 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.732 0.813 . . . . 0.0 110.29 -169.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.81 175.44 15.26 Favored Glycine 0 CA--C 1.527 0.843 0 N-CA-C 110.358 -1.097 . . . . 0.0 110.358 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -54.63 122.09 10.96 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.807 2.338 . . . . 0.0 108.061 170.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -121.14 9.53 10.51 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -169.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -132.28 92.4 3.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 169.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.5 mm -138.24 134.19 44.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 104.77 -2.308 . . . . 0.0 104.77 -174.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -123.71 -28.5 3.84 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 123.468 0.707 . . . . 0.0 111.261 -169.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.22 162.91 23.16 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 125.717 1.607 . . . . 0.0 107.322 175.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.1 117.98 3.22 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.694 2.263 . . . . 0.0 110.893 169.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.85 1.01 77.42 Favored Glycine 0 CA--C 1.53 0.97 0 CA-C-O 117.931 -1.483 . . . . 0.0 114.064 178.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.3 t -128.9 118.91 48.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 119.803 1.801 . . . . 0.0 108.698 -169.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -121.31 166.89 13.39 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.554 1.542 . . . . 0.0 110.104 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.0 ttm -135.8 60.63 37.1 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 123.166 0.586 . . . . 0.0 110.163 172.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -59.3 121.22 9.54 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 121.946 1.764 . . . . 0.0 110.15 -171.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -172.5 162.49 5.28 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 127.634 2.374 . . . . 0.0 107.173 -169.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.87 172.42 13.04 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.709 1.204 . . . . 0.0 109.867 -174.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -58.5 154.01 36.28 Favored Pre-proline 0 CA--C 1.537 0.467 0 CA-C-O 118.468 -0.777 . . . . 0.0 109.605 173.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.55 -40.03 83.74 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.462 2.108 . . . . 0.0 109.972 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -64.61 -12.59 47.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.402 1.481 . . . . 0.0 112.94 -176.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 80.9 m -77.34 -5.37 49.35 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.777 0.717 . . . . 0.0 111.965 178.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 130.69 18.44 1.41 Allowed Glycine 0 CA--C 1.524 0.607 0 CA-C-O 118.405 -1.219 . . . . 0.0 113.112 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.09 146.07 53.81 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 119.281 1.541 . . . . 0.0 109.026 169.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.8 mt -132.77 -29.47 1.5 Allowed 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 123.973 0.909 . . . . 0.0 111.183 -173.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.5 mttt -147.17 156.15 42.73 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.031 1.332 . . . . 0.0 107.827 177.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 93.7 m -88.28 128.57 35.48 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 123.04 0.536 . . . . 0.0 111.057 -176.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -176.92 -178.8 46.95 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.347 1.451 . . . . 0.0 110.854 -176.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 53.5 mtt -148.57 172.46 14.49 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 127.018 2.127 . . . . 0.0 110.077 -175.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.7 m -152.75 168.21 26.45 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.209 1.403 . . . . 0.0 109.157 169.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.9 tp -145.59 125.51 13.56 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.448 1.899 . . . . 0.0 108.737 -169.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 73.2 m -133.56 145.33 49.99 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.974 1.31 . . . . 0.0 108.296 -176.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.6 tt -136.29 132.77 36.16 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 174.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.2 mp -114.09 121.31 43.44 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 126.865 2.066 . . . . 0.0 106.376 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -60.77 -36.91 80.17 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.247 0.93 . . . . 0.0 112.745 -177.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -92.96 -14.93 26.86 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.286 0.634 . . . . 0.0 112.156 176.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.97 -176.44 21.67 Favored Glycine 0 CA--C 1.534 1.271 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 -168.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.2 p -150.66 164.43 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 O-C-N 121.663 -0.904 . . . . 0.0 108.659 169.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -102.37 110.71 22.74 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.458 0.647 . . . . 0.0 109.837 -169.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -82.65 118.89 73.34 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 125.594 1.558 . . . . 0.0 108.118 170.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -61.63 112.96 1.61 Allowed 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 123.181 2.587 . . . . 0.0 110.847 -170.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 126.81 -17.85 6.34 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 124.588 1.089 . . . . 0.0 112.887 -178.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -132.57 97.72 4.15 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 174.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.33 -27.49 67.39 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -169.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -68.29 128.44 93.15 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.53 129.86 18.6 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.295 1.997 . . . . 0.0 109.22 -176.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 31.4 mm -72.38 107.74 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 178.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 32.0 mtpt -84.59 -18.86 34.2 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-O 117.094 -1.431 . . . . 0.0 111.513 171.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 8.4 mt -137.97 139.24 39.6 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 120.703 1.592 . . . . 0.0 111.837 -174.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mp -140.7 134.63 30.63 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 -175.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 5.0 mt -119.94 126.49 75.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 169.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.18 153.58 28.01 Favored Glycine 0 CA--C 1.522 0.517 0 N-CA-C 108.834 -1.706 . . . . 0.0 108.834 169.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -149.99 144.26 25.72 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 105.344 -2.095 . . . . 0.0 105.344 173.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 79.5 p -142.29 146.38 35.01 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 105.565 -2.013 . . . . 0.0 105.565 168.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . 0.453 ' HA ' ' HA ' ' A' ' 77' ' ' THR . . . -144.15 148.17 34.67 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 171.018 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -83.78 -13.85 52.88 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.012 -174.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -135.5 152.53 51.42 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.619 0.768 . . . . 0.0 110.171 174.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.27 -35.23 76.73 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -177.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -72.22 -31.17 65.61 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.09 -1.006 . . . . 0.0 110.808 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.3 m -63.84 -38.82 92.52 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 118.719 -0.658 . . . . 0.0 109.658 169.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 -61.93 -43.33 99.07 Favored 'General case' 0 C--N 1.344 0.345 0 CA-C-N 119.401 1.0 . . . . 0.0 110.767 172.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.8 mm -57.82 -55.57 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 119.428 1.013 . . . . 0.0 109.331 177.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -58.92 -39.32 93.92 Favored Glycine 0 CA--C 1.528 0.849 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.51 -49.05 65.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.308 1.043 . . . . 0.0 111.267 179.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.4 mm -56.36 -42.95 75.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.231 1.013 . . . . 0.0 108.643 176.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -70.98 -12.35 61.49 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.75 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -82.98 -45.51 14.01 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 169.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 92.5 mt -71.54 -26.94 62.85 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 118.887 -0.578 . . . . 0.0 112.062 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.1 m -60.83 -24.43 65.86 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.096 0.407 . . . . 0.0 111.591 170.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.53 -16.41 62.33 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.748 -1.22 . . . . 0.0 110.688 175.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 42.2 mt -104.52 -67.56 0.9 Allowed 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.322 1.049 . . . . 0.0 109.713 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 16.9 mt -75.48 -6.35 49.71 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -171.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 33.4 m -119.86 29.7 7.42 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.175 0.898 . . . . 0.0 110.457 174.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -131.33 108.5 9.69 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 172.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -57.68 -27.38 62.83 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.632 -177.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -63.78 -45.25 90.6 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.25 0.62 . . . . 0.0 110.003 176.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.54 -41.23 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 118.409 -0.805 . . . . 0.0 109.135 175.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 35.3 mt -56.14 -39.78 72.78 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 119.34 0.973 . . . . 0.0 111.231 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -69.87 -37.33 76.05 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.01 176.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -65.35 -41.44 93.85 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 119.336 0.971 . . . . 0.0 109.106 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 22.9 mt -66.19 -52.85 44.12 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 175.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 51.1 mt -59.37 -17.4 29.66 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 77.6 p -108.24 3.2 23.36 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.629 1.172 . . . . 0.0 112.09 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.45 140.19 58.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.403 1.081 . . . . 0.0 109.257 169.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -132.46 1.84 3.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.028 1.331 . . . . 0.0 111.234 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.2 m -144.28 150.62 38.19 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.115 0.966 . . . . 0.0 109.442 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.2 -43.16 92.25 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.957 1.303 . . . . 0.0 110.649 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -60.02 -35.29 74.76 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 123.054 0.542 . . . . 0.0 111.287 177.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -64.56 -40.34 95.39 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.948 0.899 . . . . 0.0 111.161 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.1 mt -65.61 -46.15 80.4 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.31 69.27 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 174.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -65.57 -38.18 88.81 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 120.52 -1.363 . . . . 0.0 109.913 174.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 66.2 mt -69.55 -35.47 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 C-N-CA 124.141 0.976 . . . . 0.0 109.562 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 27.9 mm -56.26 -50.75 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 169.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 18.7 m -65.12 -30.61 71.55 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 123.281 0.363 . . . . 0.0 110.966 -173.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -60.11 -27.61 67.17 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.218 1.407 . . . . 0.0 113.296 172.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 N-CA-C 108.79 -1.724 . . . . 0.0 108.79 -179.028 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.467 0.175 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.21 109.01 3.38 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 172.145 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -58.36 -31.69 67.85 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.6 -21.1 2.33 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.931 1.692 . . . . 0.0 113.319 177.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -64.02 -25.19 68.01 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.304 0.957 . . . . 0.0 113.468 174.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -101.19 -21.66 14.87 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -169.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -103.97 103.99 40.76 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 -170.353 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -59.19 -68.04 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.511 2.807 . . . . 0.0 113.968 -171.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.448 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.6 tp10 -163.28 -74.73 0.04 OUTLIER 'General case' 0 CA--C 1.521 -0.164 0 C-N-CA 124.155 0.982 . . . . 0.0 111.028 -173.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.13 3.11 1.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.104 1.362 . . . . 0.0 111.917 177.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.448 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -66.83 -15.28 63.5 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.815 1.646 . . . . 0.0 113.24 -169.651 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.4 mp -117.83 137.27 52.3 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 -171.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.1 m -156.97 139.86 15.26 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.572 0.624 . . . . 0.0 110.917 176.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 92.7 t -105.0 137.11 35.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 104.764 -2.31 . . . . 0.0 104.764 169.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.403 HG21 ' H ' ' A' ' 17' ' ' SER . 40.9 mt -137.74 148.81 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 -176.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -66.05 -45.82 79.99 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.584 -0.697 . . . . 0.0 110.733 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.403 ' H ' HG21 ' A' ' 15' ' ' ILE . 5.1 p -164.9 144.39 6.98 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.815 1.246 . . . . 0.0 108.144 -176.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.23 156.75 28.0 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 169.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -60.05 -40.92 91.07 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.576 176.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -167.41 -177.49 3.63 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 128.201 2.6 . . . . 0.0 107.505 171.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -62.17 -34.15 75.88 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.451 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.5 mt-30 -60.66 -48.43 81.81 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.578 1.535 . . . . 0.0 107.906 173.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -62.64 -35.86 80.96 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 121.307 -0.871 . . . . 0.0 111.451 176.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.93 82.4 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.766 -0.584 . . . . 0.0 110.544 -178.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -65.64 -47.89 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 172.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -58.44 -48.02 82.08 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 118.434 0.561 . . . . 0.0 110.762 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -59.7 -30.01 68.49 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.287 1.035 . . . . 0.0 111.356 174.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 31.5 m -84.58 -9.91 57.87 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 119.383 0.992 . . . . 0.0 113.565 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.2 mmt -124.72 -21.52 4.78 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 119.99 1.268 . . . . 0.0 112.757 -172.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.22 -37.28 55.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 120.489 1.495 . . . . 0.0 111.125 -175.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 m -64.48 -25.71 68.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.598 -0.689 . . . . 0.0 112.425 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.6 mt -87.51 -40.98 13.83 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.127 0.971 . . . . 0.0 109.061 175.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.2 tp -56.15 -41.72 75.84 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.563 1.145 . . . . 0.0 110.4 176.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.67 -32.64 74.31 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 125.426 1.49 . . . . 0.0 112.673 -174.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.3 mmtt -94.69 15.84 17.21 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.217 0.462 . . . . 0.0 110.818 173.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.33 3.5 p30 46.89 42.57 12.36 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.889 1.675 . . . . 0.0 114.079 -172.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -69.88 -21.84 63.29 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.501 -0.749 . . . . 0.0 109.324 168.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.6 pt -147.12 170.43 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 127.096 2.158 . . . . 0.0 108.159 -174.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.8 p -105.85 168.13 9.32 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.039 1.336 . . . . 0.0 109.187 169.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.89 -30.06 71.18 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.254 -0.904 . . . . 0.0 111.997 -175.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -60.59 -32.55 71.65 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 121.788 -0.57 . . . . 0.0 111.474 175.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -59.88 -43.42 94.74 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.539 0.609 . . . . 0.0 110.563 -177.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.1 mp -55.33 -50.11 67.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 123.315 0.646 . . . . 0.0 109.365 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -71.43 -25.38 62.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.665 -0.683 . . . . 0.0 111.923 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.58 -43.82 97.85 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 119.434 1.015 . . . . 0.0 110.801 173.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.4 mt -63.99 -45.41 96.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.451 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.8 mttt -61.62 -37.98 85.96 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 122.042 -0.411 . . . . 0.0 110.229 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.45 -43.49 94.1 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 119.083 0.856 . . . . 0.0 111.33 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 49.4 m -59.12 -38.75 80.34 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.753 0.706 . . . . 0.0 110.611 171.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.5 m -64.51 -40.4 95.57 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.564 0.746 . . . . 0.0 111.064 178.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.94 -44.22 99.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 119.444 1.02 . . . . 0.0 109.122 173.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -72.61 -36.24 68.05 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -170.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -141.14 9.19 2.09 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -167.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 69.19 -169.86 42.57 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 110.038 -1.225 . . . . 0.0 110.038 -169.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -64.13 108.49 0.97 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.195 1.93 . . . . 0.0 108.085 177.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -89.56 1.08 56.42 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -169.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -130.91 108.79 10.08 Favored 'General case' 0 C--O 1.231 0.108 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 169.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.5 mm -141.01 134.54 31.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 103.114 -2.921 . . . . 0.0 103.114 -178.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mp -130.62 -21.2 2.82 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -169.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.29 160.43 30.45 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 172.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -57.67 121.36 9.89 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 121.927 1.751 . . . . 0.0 109.565 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.54 2.53 76.08 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-O 117.895 -1.503 . . . . 0.0 114.445 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.7 t -133.39 118.67 32.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-N 120.312 2.056 . . . . 0.0 109.275 -169.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -116.19 163.35 16.1 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.362 1.465 . . . . 0.0 109.818 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 7.5 ttm -137.79 61.08 27.54 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-O 118.59 -0.719 . . . . 0.0 109.862 171.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . 0.28 93.7 Cg_exo -31.22 -85.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.016 1 C-N-CA 125.786 4.324 . . . . 0.0 118.763 -168.305 . . . . . . . . 3 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 54.72 164.13 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 126.905 2.082 . . . . 0.0 114.61 -176.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -141.97 155.87 45.46 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 126.478 1.911 . . . . 0.0 106.916 170.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -50.86 147.75 8.31 Favored Pre-proline 0 CA--C 1.536 0.42 0 CA-C-O 118.08 -0.962 . . . . 0.0 110.034 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_exo -46.68 -41.97 24.18 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.217 2.611 . . . . 0.0 112.876 176.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -61.6 -14.28 29.1 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.799 1.24 . . . . 0.0 113.842 -177.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.2 m -79.84 -3.08 46.31 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.712 0.805 . . . . 0.0 112.247 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.66 18.92 1.72 Allowed Glycine 0 C--N 1.336 0.562 0 CA-C-O 118.748 -1.029 . . . . 0.0 112.959 175.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.4 148.67 49.29 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 119.468 1.634 . . . . 0.0 109.269 170.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 76.5 mt -131.9 -32.25 1.45 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 124.828 1.251 . . . . 0.0 110.77 -175.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -143.31 163.15 33.79 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.942 1.697 . . . . 0.0 107.816 178.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.3 m -97.71 122.62 41.01 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 123.189 0.596 . . . . 0.0 109.91 -177.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -168.88 179.83 41.44 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.25 1.405 . . . . 0.0 111.348 -176.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 52.1 mtt -149.02 168.34 23.39 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.44 1.496 . . . . 0.0 111.23 -170.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.2 p -148.54 164.91 32.8 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.454 1.502 . . . . 0.0 109.852 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.1 tp -146.28 90.03 1.92 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.602 1.561 . . . . 0.0 109.923 -169.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.1 m -97.45 143.75 27.86 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.0 tp -133.25 136.78 45.76 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 169.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -115.69 116.34 27.91 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 104.705 -2.331 . . . . 0.0 104.705 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.42 -33.44 75.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 118.701 0.682 . . . . 0.0 112.328 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -85.48 -13.43 49.14 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.919 0.888 . . . . 0.0 111.722 173.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 68.75 177.23 13.7 Favored Glycine 0 CA--C 1.533 1.181 0 N-CA-C 110.265 -1.134 . . . . 0.0 110.265 -168.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -146.12 161.15 10.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 168.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.95 103.0 11.96 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 121.409 -0.807 . . . . 0.0 110.024 -169.263 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -67.0 142.06 97.07 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 114.924 -1.035 . . . . 0.0 109.097 170.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -63.79 137.67 59.65 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.929 2.419 . . . . 0.0 111.754 -169.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 71.49 0.18 37.45 Favored Glycine 0 CA--C 1.531 1.065 0 CA-C-O 118.527 -1.152 . . . . 0.0 114.962 170.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -75.96 166.23 23.8 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.681 1.741 . . . . 0.0 110.633 178.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -64.51 -38.87 92.53 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.938 -0.476 . . . . 0.0 111.77 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -152.7 169.28 9.88 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 124.524 1.13 . . . . 0.0 112.43 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -56.16 159.74 11.98 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 124.195 3.263 . . . . 0.0 114.041 174.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 27.0 mm -108.1 123.5 63.68 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -89.05 -32.52 17.53 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-O 116.819 -1.562 . . . . 0.0 109.878 169.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.9 tp -130.49 144.09 51.18 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 121.1 1.773 . . . . 0.0 112.297 -172.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.3 mp -132.95 109.16 9.38 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.008 1.323 . . . . 0.0 107.707 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -87.74 115.27 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 104.72 -2.326 . . . . 0.0 104.72 168.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.73 153.33 29.77 Favored Glycine 0 CA--C 1.527 0.784 0 N-CA-C 109.321 -1.511 . . . . 0.0 109.321 170.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -145.35 144.35 30.65 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 103.872 -2.64 . . . . 0.0 103.872 171.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.3 m -142.32 142.47 32.51 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 169.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -145.1 136.3 24.96 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -170.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.85 -24.46 52.67 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.907 0.483 . . . . 0.0 111.889 -175.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -143.53 157.41 44.46 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.896 0.878 . . . . 0.0 110.081 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.31 -35.12 73.22 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.52 -32.4 60.48 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.904 -1.122 . . . . 0.0 111.033 177.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.8 m -62.02 -42.28 99.0 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 169.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 22.2 t60 -57.71 -49.04 77.87 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.134 0.974 . . . . 0.0 110.17 173.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.4 mm -56.41 -54.98 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 118.89 0.768 . . . . 0.0 109.604 179.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.71 -38.85 94.46 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-N 118.549 0.613 . . . . 0.0 111.582 -176.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.37 -49.86 57.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.674 1.189 . . . . 0.0 110.901 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.0 mm -55.83 -42.7 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.588 1.155 . . . . 0.0 109.145 176.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.7 mm-40 -69.54 -14.59 62.93 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 118.381 -0.818 . . . . 0.0 111.936 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.85 -42.34 16.51 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 170.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.4 mt -68.76 -29.3 67.66 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 121.78 -0.575 . . . . 0.0 111.708 -177.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.1 m -56.61 -22.49 34.33 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 170.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -77.24 -18.29 57.76 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.584 1.084 . . . . 0.0 111.519 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 42.9 mt -103.51 -61.26 1.44 Allowed 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.971 0.908 . . . . 0.0 110.103 -177.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.51 -27.65 69.29 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.92 0.888 . . . . 0.0 113.046 -174.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.5 m -106.93 29.32 7.16 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.134 0.574 . . . . 0.0 110.577 -175.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -130.59 104.88 7.47 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 123.909 0.884 . . . . 0.0 108.686 175.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -58.63 -25.55 62.8 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.08 -177.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.53 -48.22 73.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 121.273 0.559 . . . . 0.0 109.564 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.59 -42.2 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 123.885 0.874 . . . . 0.0 109.013 175.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 45.5 mt -60.86 -33.91 73.8 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 118.714 0.688 . . . . 0.0 111.758 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -69.34 -43.46 73.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 120.821 -1.175 . . . . 0.0 109.587 172.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -62.95 -33.29 75.04 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.864 0.756 . . . . 0.0 110.321 -177.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.8 pp -81.16 -42.0 21.53 Favored 'General case' 0 C--N 1.342 0.241 0 C-N-CA 123.451 0.7 . . . . 0.0 111.2 177.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 55.2 mt -64.48 -20.25 66.07 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.551 1.069 . . . . 0.0 111.743 176.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 59.9 p -108.79 16.33 22.86 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.983 1.313 . . . . 0.0 111.167 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.39 102.62 0.71 Allowed 'General case' 0 C--N 1.346 0.42 0 CA-C-N 119.254 0.934 . . . . 0.0 111.18 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.3 m -71.75 -17.0 62.22 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.496 0.718 . . . . 0.0 112.272 175.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.3 p -153.76 162.44 41.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.813 0.733 . . . . 0.0 111.184 -171.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -57.61 -37.24 72.92 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.418 1.087 . . . . 0.0 109.401 169.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -58.39 -44.16 88.81 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-O 118.618 -0.706 . . . . 0.0 110.916 176.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -60.04 -38.13 81.86 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 119.122 0.874 . . . . 0.0 112.121 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 38.3 mt -69.9 -44.77 69.02 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.706 0.685 . . . . 0.0 109.971 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -65.55 -26.58 67.94 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.087 -1.008 . . . . 0.0 112.569 175.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -66.15 -35.81 81.47 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 120.344 -1.472 . . . . 0.0 110.826 174.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.44 -39.34 84.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.729 0.811 . . . . 0.0 109.784 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 33.7 mm -58.21 -51.51 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 173.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.9 m -65.57 -24.53 67.11 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.469 -169.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.407 ' HG3' HH11 ' A' ' 146' ' ' ARG . 2.2 ttm-85 -60.19 -25.29 65.46 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.398 1.479 . . . . 0.0 113.825 173.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.973 -0.904 . . . . 0.0 111.065 -173.666 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 tpt . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.43 112.84 1.91 Allowed 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 169.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.56 -34.01 73.53 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 169.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.9 p -59.53 -5.74 0.91 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.921 1.688 . . . . 0.0 113.413 171.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -109.19 11.54 25.44 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.098 1.359 . . . . 0.0 113.341 174.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -130.96 -46.63 1.02 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.34 1.056 . . . . 0.0 109.6 169.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -75.22 118.26 69.27 Favored Pre-proline 0 CA--C 1.542 0.642 0 N-CA-C 104.302 -2.481 . . . . 0.0 104.302 170.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.9 -78.71 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.646 2.231 . . . . 0.0 111.394 -169.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -168.5 165.39 12.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 128.316 2.646 . . . . 0.0 104.88 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 56.99 15.74 2.49 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.711 1.204 . . . . 0.0 113.719 171.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.5 m -117.53 28.64 8.33 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.95 1.3 . . . . 0.0 110.489 -169.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 mt -122.73 144.54 31.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 171.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 69.9 m -157.07 157.33 34.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.852 0.861 . . . . 0.0 109.488 169.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 99.2 t -122.21 141.06 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 104.248 -2.501 . . . . 0.0 104.248 170.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.5 mt -136.18 144.11 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 125.29 1.436 . . . . 0.0 107.86 -168.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -70.68 -36.04 73.11 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.159 -0.338 . . . . 0.0 111.24 177.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 p -175.11 146.41 0.85 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 126.299 1.84 . . . . 0.0 106.292 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.28 157.67 20.52 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 169.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -62.7 -37.11 85.18 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.009 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -165.2 -179.46 5.64 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 126.754 2.021 . . . . 0.0 107.125 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 69.0 p-90 -61.78 -35.17 77.37 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.882 0.765 . . . . 0.0 111.864 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.453 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 51.3 mt-30 -51.79 -53.94 34.32 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.64 1.176 . . . . 0.0 108.191 170.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -66.57 -34.39 77.78 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 121.684 -0.635 . . . . 0.0 111.185 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.24 -31.56 72.46 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 121.82 -0.55 . . . . 0.0 110.795 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.74 -48.3 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 170.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -56.51 -46.21 80.66 Favored 'General case' 0 C--O 1.223 -0.327 0 O-C-N 122.033 -0.417 . . . . 0.0 110.08 178.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -64.52 -29.32 70.35 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 118.003 -0.998 . . . . 0.0 112.293 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.2 m -66.93 -23.53 65.98 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 120.17 1.35 . . . . 0.0 111.869 172.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.1 mmt -123.79 -17.96 6.19 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 -168.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.8 p -57.17 -34.82 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 120.276 1.398 . . . . 0.0 112.472 -169.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.5 m -64.77 -44.65 89.34 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 118.654 0.661 . . . . 0.0 109.727 178.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 89.3 mt -65.05 -36.67 85.1 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.182 0.593 . . . . 0.0 109.709 177.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 51.1 tp -61.61 -48.25 81.76 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.22 0.608 . . . . 0.0 109.924 177.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -65.42 -37.14 86.04 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 124.157 0.983 . . . . 0.0 112.168 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -76.56 2.11 14.84 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.604 1.162 . . . . 0.0 111.859 175.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.414 0.0 OUTLIER 48.64 30.34 2.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.703 2.401 . . . . 0.0 116.019 -169.956 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -66.68 -23.66 66.16 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.11 -0.994 . . . . 0.0 109.762 168.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.0 pt -140.88 179.28 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 C-N-CA 126.063 1.745 . . . . 0.0 109.905 -177.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 m -121.09 160.53 23.47 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.899 2.08 . . . . 0.0 108.46 175.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.02 -33.23 71.72 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.318 -0.864 . . . . 0.0 112.883 -171.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -59.51 -30.82 68.84 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.864 -0.522 . . . . 0.0 111.885 176.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -61.16 -42.7 99.02 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.312 0.645 . . . . 0.0 110.574 -177.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.4 -50.38 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 174.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -68.78 -25.89 64.93 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.501 -0.762 . . . . 0.0 112.003 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.76 98.22 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 119.473 1.033 . . . . 0.0 110.909 174.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.9 mt -66.96 -44.06 88.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.453 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.6 mttt -60.9 -44.64 96.86 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.352 0.523 . . . . 0.0 109.915 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.69 -37.28 86.75 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.125 0.97 . . . . 0.0 111.47 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.0 m -63.31 -38.02 89.54 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.635 -0.666 . . . . 0.0 110.44 172.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 17.5 m -66.73 -35.38 79.98 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.434 0.694 . . . . 0.0 110.738 176.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 95.4 mt -65.11 -44.09 95.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 119.221 0.919 . . . . 0.0 109.638 171.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -64.91 -34.91 79.52 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.61 0.764 . . . . 0.0 112.561 -169.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -149.96 -48.43 0.13 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.087 0.555 . . . . 0.0 111.309 -169.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 146.56 -178.64 24.09 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 109.084 -1.607 . . . . 0.0 109.084 -173.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -60.19 122.66 11.7 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 122.332 2.021 . . . . 0.0 109.619 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -80.02 -17.66 52.24 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -172.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -129.57 95.69 4.06 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 -171.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.1 mm -135.2 142.42 39.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 126.6 1.96 . . . . 0.0 105.914 -174.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mp -132.16 -28.6 1.7 Allowed 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.38 0.672 . . . . 0.0 112.124 -173.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.13 164.87 20.2 Favored Pre-proline 0 C--O 1.238 0.47 0 C-N-CA 125.11 1.364 . . . . 0.0 107.596 173.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.13 123.45 11.0 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.28 1.987 . . . . 0.0 109.507 169.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.54 3.66 90.43 Favored Glycine 0 CA--C 1.535 1.338 0 CA-C-O 117.892 -1.504 . . . . 0.0 115.204 178.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 58.0 t -128.27 122.76 58.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 120.241 2.021 . . . . 0.0 108.56 -173.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.78 163.05 23.71 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 124.948 1.299 . . . . 0.0 110.262 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.2 ttm -132.8 60.46 50.11 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 123.414 0.686 . . . . 0.0 111.64 175.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -50.59 143.62 27.79 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.304 2.003 . . . . 0.0 114.432 -171.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -179.72 154.9 0.62 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 128.205 2.602 . . . . 0.0 106.672 -169.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.07 161.66 36.17 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 125.515 1.526 . . . . 0.0 107.631 169.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.6 ptt85 -49.93 139.56 17.08 Favored Pre-proline 0 CA--C 1.54 0.568 0 CA-C-O 118.079 -0.962 . . . . 0.0 109.729 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -46.89 -43.26 24.38 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 123.692 2.928 . . . . 0.0 113.008 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.08 -9.65 11.33 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.484 1.514 . . . . 0.0 114.368 -177.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 64.0 m -76.47 -3.91 39.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.011 0.823 . . . . 0.0 112.388 172.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 132.66 13.29 1.65 Allowed Glycine 0 C--N 1.334 0.456 0 CA-C-O 118.305 -1.275 . . . . 0.0 113.373 171.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.4 145.17 56.16 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.296 1.548 . . . . 0.0 109.231 169.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.0 mt -126.2 -33.92 2.58 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 124.444 1.098 . . . . 0.0 110.261 -175.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -139.52 168.59 19.48 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.103 1.761 . . . . 0.0 107.873 176.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 96.9 m -98.8 118.53 35.75 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 123.351 0.66 . . . . 0.0 109.247 177.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -165.63 177.82 40.7 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 123.804 0.716 . . . . 0.0 112.382 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 59.0 mtt -142.22 166.97 23.24 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.737 1.269 . . . . 0.0 112.841 -171.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.2 p -145.58 158.55 43.83 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.264 1.826 . . . . 0.0 108.762 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 mp -134.44 133.16 40.18 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.988 1.315 . . . . 0.0 107.542 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 26.6 m -139.05 134.9 33.6 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -174.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.1 tp -123.56 142.18 51.28 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 169.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.9 mp -121.34 115.98 23.95 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 126.973 2.109 . . . . 0.0 105.584 177.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -62.99 -25.03 68.19 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.115 0.966 . . . . 0.0 112.486 -174.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -110.52 -7.98 14.68 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.8 1.24 . . . . 0.0 111.765 177.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 59.39 -176.37 2.94 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 123.842 0.734 . . . . 0.0 112.065 -169.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -151.49 157.92 5.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 169.146 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -98.26 109.77 22.47 Favored 'General case' 0 C--N 1.333 -0.133 0 O-C-N 121.182 -0.949 . . . . 0.0 112.139 -169.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -82.85 114.74 54.43 Favored Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 106.241 -1.762 . . . . 0.0 106.241 169.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -61.34 108.13 0.56 Allowed 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.557 2.171 . . . . 0.0 110.936 -169.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 140.78 -31.19 2.23 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-O 118.808 -0.996 . . . . 0.0 113.153 177.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -69.9 162.0 28.85 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.169 1.485 . . . . 0.0 110.093 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -64.71 -32.95 74.85 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.857 -0.527 . . . . 0.0 112.072 174.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -147.24 170.2 8.13 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 124.593 1.157 . . . . 0.0 112.228 -175.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -52.33 130.76 37.21 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 123.3 2.667 . . . . 0.0 111.612 174.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 28.4 mm -69.11 119.25 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.1 mtpt -97.14 -17.35 19.97 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.851 -1.071 . . . . 0.0 110.78 174.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 59.5 tp -142.09 128.44 19.98 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 119.951 1.251 . . . . 0.0 110.412 -169.388 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.1 mp -137.82 113.56 9.71 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -170.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.2 mp -100.16 111.56 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 175.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.7 147.79 31.33 Favored Glycine 0 CA--C 1.529 0.954 0 N-CA-C 110.065 -1.214 . . . . 0.0 110.065 173.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.34 141.05 37.66 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 171.09 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 28.5 p -131.33 142.34 50.07 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 127.58 2.352 . . . . 0.0 106.533 171.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -145.86 133.6 21.12 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.61 -22.17 57.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 122.818 0.447 . . . . 0.0 111.42 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -145.83 154.49 42.05 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.141 0.977 . . . . 0.0 109.77 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.04 -31.69 69.07 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -177.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -77.61 -32.85 53.77 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.24 0.927 . . . . 0.0 111.373 178.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 4.4 m -60.95 -42.88 99.1 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 169.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -48.83 77.01 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.539 1.136 . . . . 0.0 110.51 171.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 6.0 mm -58.24 -45.56 88.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 123.37 0.668 . . . . 0.0 110.57 -177.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -73.96 -33.64 57.09 Favored Glycine 0 CA--C 1.529 0.917 0 CA-C-N 119.715 1.143 . . . . 0.0 111.597 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.66 -46.96 80.23 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.122 0.969 . . . . 0.0 110.886 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -54.39 -45.04 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 125.076 1.35 . . . . 0.0 108.444 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -69.19 -9.96 55.43 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 118.297 -0.858 . . . . 0.0 112.807 -178.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -90.36 -38.43 13.34 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 119.796 1.18 . . . . 0.0 109.056 170.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.76 -31.82 65.2 Favored 'General case' 0 CA--C 1.517 -0.321 0 O-C-N 121.759 -0.588 . . . . 0.0 111.055 -178.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.2 m -61.09 -20.91 63.17 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.495 0.718 . . . . 0.0 112.108 173.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -66.95 -25.19 66.22 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.656 1.116 . . . . 0.0 110.212 174.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 41.5 mt -103.04 -61.38 1.41 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.132 0.973 . . . . 0.0 111.046 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.98 -1.22 18.94 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -172.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 37.1 m -114.91 26.47 10.13 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.6 1.091 . . . . 0.0 111.653 173.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -138.58 96.73 3.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 -172.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -58.23 -23.91 57.47 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.677 0.791 . . . . 0.0 112.501 -173.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -62.73 -49.59 74.43 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 121.323 0.582 . . . . 0.0 109.624 174.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.82 -40.37 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 C-N-CA 124.646 1.178 . . . . 0.0 109.51 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 31.9 mt -54.79 -43.49 72.91 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 118.574 -0.727 . . . . 0.0 111.18 -172.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -67.17 -38.15 84.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 118.693 0.679 . . . . 0.0 110.708 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -70.17 -32.64 70.69 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.038 0.535 . . . . 0.0 110.098 -176.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 30.2 mt -72.78 -52.5 14.75 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 169.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.2 mt -58.59 -11.62 3.22 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.512 1.125 . . . . 0.0 113.746 -175.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 62.5 p -116.12 15.67 16.02 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.101 1.361 . . . . 0.0 110.797 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.44 95.41 0.02 OUTLIER 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.02 1.328 . . . . 0.0 110.73 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 50.7 m -82.39 -14.59 54.97 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.686 0.794 . . . . 0.0 111.099 -176.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.2 m -146.76 154.98 42.03 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 125.929 1.692 . . . . 0.0 106.728 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -54.88 -35.1 63.73 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.042 1.337 . . . . 0.0 111.687 178.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -53.22 -36.23 60.8 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.18 0.592 . . . . 0.0 111.988 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -64.79 -35.85 82.41 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 123.999 0.919 . . . . 0.0 112.426 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 59.3 mt -67.83 -44.12 77.95 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -75.08 -24.13 58.13 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -176.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -60.22 -44.45 95.16 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 120.736 -1.228 . . . . 0.0 109.658 171.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 96.6 mt -68.87 -35.53 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 C-N-CA 124.581 1.153 . . . . 0.0 109.792 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.9 -49.78 72.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 122.958 0.503 . . . . 0.0 110.315 169.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 39.3 m -64.79 -27.19 68.72 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -168.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 18.3 mtt180 -69.56 -25.85 64.2 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.201 0.6 . . . . 0.0 111.596 175.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.865 0 C-N-CA 125.815 1.674 . . . . 0.0 111.449 -169.583 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 tpt . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 110.202 -0.295 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -66.1 109.28 2.54 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 168.782 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -54.02 -45.19 71.49 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.35 -19.22 5.08 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.913 1.685 . . . . 0.0 113.712 -178.032 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -66.64 -30.7 71.03 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-N 119.494 1.043 . . . . 0.0 111.967 176.621 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -86.56 -34.46 19.92 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.902 -0.571 . . . . 0.0 112.042 -174.137 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -90.08 104.47 8.7 Favored Pre-proline 0 N--CA 1.471 0.608 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 -173.491 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.05 -66.11 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 122.935 2.423 . . . . 0.0 113.863 -169.368 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.426 ' C ' ' H ' ' A' ' 11' ' ' SER . 34.9 tt0 -167.49 -64.73 0.03 OUTLIER 'General case' 0 C--O 1.231 0.127 0 C-N-CA 125.49 1.516 . . . . 0.0 109.792 178.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -69.18 5.76 1.15 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.156 1.382 . . . . 0.0 112.26 177.159 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' SER . . . . . 0.426 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -63.44 -29.84 71.06 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 126.116 1.767 . . . . 0.0 111.216 -174.019 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.1 mm -91.23 134.96 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.323 0 C-N-CA 125.734 1.613 . . . . 0.0 107.109 -169.781 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.4 m -157.27 151.52 24.94 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.238 0.926 . . . . 0.0 111.223 170.717 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 76.5 t -122.62 143.55 35.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 169.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.8 mt -140.89 147.8 22.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -170.023 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -73.55 -47.14 43.04 Favored 'General case' 0 CA--C 1.531 0.218 0 O-C-N 121.701 -0.624 . . . . 0.0 109.935 172.055 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.9 p -161.85 146.28 12.76 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -177.661 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.93 158.81 29.2 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 169.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.97 -43.63 86.58 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.525 0.73 . . . . 0.0 109.956 174.787 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -167.78 178.03 5.46 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 128.377 2.671 . . . . 0.0 107.452 175.067 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -57.5 -35.6 70.44 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 126.021 1.729 . . . . 0.0 113.734 176.767 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.4 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.4 mt-30 -62.32 -51.18 68.68 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 120.52 1.509 . . . . 0.0 108.308 171.772 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -59.83 -34.26 72.86 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 121.76 -0.587 . . . . 0.0 111.501 179.176 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.87 -32.67 74.49 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.584 -0.698 . . . . 0.0 110.919 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.59 -45.82 81.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 172.113 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -56.72 -42.8 79.83 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 121.624 -0.673 . . . . 0.0 110.569 176.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -70.31 -16.37 63.0 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.222 -0.924 . . . . 0.0 112.996 174.209 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m -79.49 -19.11 50.51 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 120.088 1.313 . . . . 0.0 110.916 169.25 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 7.9 mmt -126.36 -17.42 5.16 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 -168.615 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -59.67 -36.15 63.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 120.908 1.685 . . . . 0.0 112.03 -169.37 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.0 m -61.83 -26.81 68.35 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.839 0.745 . . . . 0.0 112.074 179.42 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.8 mt -86.25 -43.83 12.63 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.96 1.304 . . . . 0.0 108.62 177.012 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.7 tp -55.89 -41.93 75.19 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.79 0.836 . . . . 0.0 110.779 177.638 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -60.16 -30.2 69.17 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 126.199 1.8 . . . . 0.0 113.556 -174.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.9 mttm -111.54 20.05 17.55 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -177.262 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.341 0.7 OUTLIER 47.47 35.99 4.69 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.403 1.881 . . . . 0.0 114.911 -176.022 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.6 m-85 -64.51 -22.18 66.89 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.258 -0.901 . . . . 0.0 110.112 168.574 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.7 pt -146.12 165.7 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 127.303 2.241 . . . . 0.0 107.569 -177.122 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.4 p -98.5 166.86 11.16 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.3 1.04 . . . . 0.0 108.864 169.292 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -60.72 -31.38 70.67 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.283 -0.886 . . . . 0.0 111.726 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -59.46 -32.86 70.62 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 122.935 0.494 . . . . 0.0 111.626 176.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -59.37 -45.97 89.95 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.964 0.505 . . . . 0.0 110.329 -179.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.01 -49.79 82.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 176.559 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -68.53 -27.24 65.92 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 118.27 -0.872 . . . . 0.0 112.082 -173.636 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.71 -45.0 90.53 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 119.417 1.008 . . . . 0.0 110.557 172.697 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 25.4 mt -68.52 -46.72 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 -178.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.4 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.7 mttt -59.73 -47.69 84.64 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -177.432 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.13 -44.08 97.43 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 123.85 0.86 . . . . 0.0 110.846 -177.176 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 m -59.74 -48.71 80.59 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.463 0.705 . . . . 0.0 109.942 175.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 69.4 m -58.03 -43.49 86.8 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.141 0.976 . . . . 0.0 111.27 178.912 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 73.3 mt -65.89 -41.21 89.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 O-C-N 121.365 -0.834 . . . . 0.0 109.695 177.787 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -72.23 -37.76 69.1 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -172.179 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -141.76 11.08 2.04 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -167.542 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 78.67 170.49 37.86 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 -169.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -63.41 153.28 75.59 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 122.964 2.443 . . . . 0.0 111.159 -176.533 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -109.4 -8.54 15.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.66 0.784 . . . . 0.0 112.115 -174.287 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -136.0 77.06 1.64 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.243 1.017 . . . . 0.0 108.729 -169.607 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.8 mm -120.97 135.24 61.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 175.552 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.73 -31.44 4.25 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 122.965 0.506 . . . . 0.0 111.854 -169.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.82 164.01 18.46 Favored Pre-proline 0 C--O 1.236 0.368 0 C-N-CA 125.261 1.424 . . . . 0.0 107.532 -177.64 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -45.9 115.2 0.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.306 2.671 . . . . 0.0 111.853 171.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.55 1.07 87.88 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-O 117.719 -1.601 . . . . 0.0 114.693 176.199 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 69.9 t -124.93 122.13 62.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 119.966 1.883 . . . . 0.0 108.572 -169.925 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.12 169.76 11.38 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.372 1.469 . . . . 0.0 109.643 176.373 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 ttm -139.95 59.92 14.26 Favored Pre-proline 0 CA--C 1.537 0.445 0 C-N-CA 123.761 0.824 . . . . 0.0 110.698 174.458 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -57.24 123.85 14.79 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 121.232 1.288 . . . . 0.0 109.83 -174.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -167.08 172.46 10.05 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.129 2.572 . . . . 0.0 108.454 174.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -132.94 171.09 14.42 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.079 1.352 . . . . 0.0 110.24 -174.27 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -57.03 155.36 16.17 Favored Pre-proline 0 N--CA 1.472 0.632 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.602 173.082 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -61.26 -35.67 83.63 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 121.57 1.513 . . . . 0.0 109.361 -176.784 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -67.65 -12.72 61.09 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.971 1.309 . . . . 0.0 112.437 -176.338 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 71.0 m -79.96 -3.3 47.68 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.755 0.707 . . . . 0.0 111.669 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 130.55 19.99 1.28 Allowed Glycine 0 C--N 1.337 0.626 0 CA-C-O 118.33 -1.261 . . . . 0.0 113.343 175.324 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.09 146.12 52.85 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 119.792 1.796 . . . . 0.0 109.041 169.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.1 mt -133.71 -28.93 1.37 Allowed 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.776 1.23 . . . . 0.0 111.045 -173.659 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -139.91 174.0 10.95 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.226 1.81 . . . . 0.0 107.749 172.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 95.1 m -105.92 126.44 52.18 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.353 1.061 . . . . 0.0 110.613 176.128 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.99 -176.14 41.33 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 125.865 1.698 . . . . 0.0 111.661 -177.597 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 42.1 mtt -146.66 171.3 15.32 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.762 1.625 . . . . 0.0 111.902 -176.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.6 m -136.4 161.72 35.05 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.56 1.944 . . . . 0.0 108.469 174.546 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 30.5 tp -142.52 103.18 4.2 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.21 1.404 . . . . 0.0 108.137 178.508 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 89.7 m -121.76 138.53 54.33 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.97 0.908 . . . . 0.0 108.732 -171.577 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.1 tt -134.33 133.28 40.51 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 124.214 1.005 . . . . 0.0 108.412 179.095 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.7 mp -113.51 122.14 46.37 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 126.16 1.784 . . . . 0.0 107.122 179.554 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -60.56 -40.97 93.58 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 118.931 0.787 . . . . 0.0 111.738 -178.727 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -87.54 -20.95 25.75 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 124.371 1.068 . . . . 0.0 111.414 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.5 -177.61 21.0 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 110.591 -1.003 . . . . 0.0 110.591 -168.708 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -148.56 167.54 3.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 169.241 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -120.03 95.99 4.98 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 121.756 -0.59 . . . . 0.0 110.205 -169.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -50.2 137.85 20.84 Favored Pre-proline 0 CA--C 1.539 0.527 0 C-N-CA 123.163 0.585 . . . . 0.0 110.392 170.834 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -59.75 130.12 33.73 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 122.89 2.393 . . . . 0.0 110.761 -174.316 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 67.89 9.1 55.7 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 118.158 -1.356 . . . . 0.0 114.665 173.157 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -72.0 168.88 17.11 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 120.169 1.985 . . . . 0.0 109.833 171.877 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.12 -38.68 88.77 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.488 -0.757 . . . . 0.0 111.675 176.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -155.64 167.66 13.77 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.546 1.138 . . . . 0.0 111.893 -172.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.98 159.7 47.42 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.917 2.411 . . . . 0.0 111.999 178.186 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 36.3 mm -112.99 139.27 39.02 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.357 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -178.266 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -116.94 -7.73 11.36 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 117.835 -1.079 . . . . 0.0 110.743 175.644 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 15.4 tp -145.1 134.08 22.55 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 120.161 1.346 . . . . 0.0 110.712 -176.775 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mp -138.52 111.6 7.9 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 -169.769 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.8 mp -92.84 114.79 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 172.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.16 154.02 47.37 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 170.002 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -143.77 150.4 38.51 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 169.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.0 p -144.5 142.29 30.14 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 168.815 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.59 132.75 15.35 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 119.395 0.998 . . . . 0.0 108.505 -179.653 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.28 -19.85 57.9 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.818 -174.176 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -140.48 154.59 46.65 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.888 0.875 . . . . 0.0 110.352 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.82 -37.46 76.45 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -178.161 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -71.85 -30.22 65.22 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.966 -1.083 . . . . 0.0 110.83 176.43 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.3 m -65.87 -36.42 83.38 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.437 169.835 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 49.9 m-70 -59.82 -48.87 79.94 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 119.858 1.208 . . . . 0.0 109.476 170.857 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.3 mm -55.34 -54.65 22.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-N 118.703 0.683 . . . . 0.0 109.35 179.518 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.29 -39.25 96.95 Favored Glycine 0 CA--C 1.53 0.997 0 CA-C-N 118.888 0.767 . . . . 0.0 111.692 -176.183 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.67 -54.97 20.28 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.912 0.885 . . . . 0.0 110.373 179.007 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.6 mm -51.6 -48.24 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 C-N-CA 125.901 1.68 . . . . 0.0 108.424 177.037 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -66.79 -18.01 65.16 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.503 -0.748 . . . . 0.0 111.876 -176.524 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.86 -48.4 8.79 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 123.691 0.796 . . . . 0.0 109.369 173.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.2 pp -67.57 -23.56 65.42 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 118.24 0.473 . . . . 0.0 112.131 -178.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 60.2 m -62.95 -22.91 67.13 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.863 0.865 . . . . 0.0 111.726 174.056 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -66.17 -17.46 64.74 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.945 0.793 . . . . 0.0 110.035 173.505 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 34.8 mt -108.62 -60.94 1.67 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.009 1.324 . . . . 0.0 110.119 179.456 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 9.9 mt -62.77 -21.03 65.55 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.877 1.436 . . . . 0.0 114.877 -175.604 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 38.1 m -111.13 26.15 11.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.945 0.793 . . . . 0.0 110.826 -179.201 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -132.51 97.38 4.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.064 1.346 . . . . 0.0 107.74 178.409 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.06 -27.8 54.92 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.691 0.797 . . . . 0.0 112.456 -177.128 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -65.12 -44.55 88.34 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 123.163 0.585 . . . . 0.0 110.02 176.584 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.92 -43.31 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 174.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.8 mt -55.66 -43.5 76.35 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 118.58 0.627 . . . . 0.0 111.128 -174.532 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -67.37 -38.85 85.41 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.775 0.43 . . . . 0.0 110.614 178.797 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -70.03 -33.23 71.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 118.663 0.665 . . . . 0.0 109.91 -176.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 32.4 mt -68.3 -56.31 9.05 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 169.834 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 40.3 mt -57.64 -12.12 2.63 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 -174.395 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 50.9 p -114.11 7.45 16.69 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.067 1.347 . . . . 0.0 111.433 179.358 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.48 110.86 1.2 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.499 1.519 . . . . 0.0 110.235 175.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.6 m -68.25 -28.02 66.85 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.099 0.559 . . . . 0.0 111.838 176.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.2 m -149.54 160.53 43.4 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.056 1.343 . . . . 0.0 108.917 -172.183 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 57.2 mp0 -54.24 -34.47 60.79 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.119 1.367 . . . . 0.0 111.408 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -53.22 -38.27 62.77 Favored 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 123.119 0.568 . . . . 0.0 112.442 -179.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -80.75 -27.7 36.72 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 119.024 0.829 . . . . 0.0 110.605 -178.234 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.9 mt -65.48 -50.5 65.11 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.434 1.015 . . . . 0.0 108.303 171.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.72 -33.94 73.66 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.123 0.969 . . . . 0.0 112.679 176.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -59.83 -43.45 94.56 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 118.955 0.798 . . . . 0.0 110.677 175.185 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 77.4 mt -70.5 -35.12 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 123.166 0.586 . . . . 0.0 109.716 -178.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.3 mm -57.17 -52.37 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 169.469 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 21.4 m -65.1 -27.83 69.03 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.279 -170.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -59.3 -24.55 63.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.275 1.83 . . . . 0.0 113.601 174.565 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.931 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 -176.966 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.484 1.249 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -58.71 121.09 10.2 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 169.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.79 -45.42 78.48 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.7 m -52.91 -28.03 21.45 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.29 1.436 . . . . 0.0 113.701 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -58.15 -27.53 63.88 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.771 0.829 . . . . 0.0 112.343 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -92.68 -7.26 47.3 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.886 0.875 . . . . 0.0 112.851 -177.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -108.7 106.01 57.99 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 119.967 1.258 . . . . 0.0 108.568 -171.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.87 -62.22 0.12 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.598 2.199 . . . . 0.0 113.299 -173.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -174.33 -65.93 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.67 1.188 . . . . 0.0 109.182 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.1 m -73.26 2.97 6.37 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.229 1.411 . . . . 0.0 112.604 -176.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.19 -4.01 15.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 128.436 2.694 . . . . 0.0 114.289 -169.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 21.0 mt -126.55 127.12 70.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 120.332 1.423 . . . . 0.0 108.188 -168.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.9 m -143.36 145.92 33.09 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.292 1.037 . . . . 0.0 111.308 -171.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.9 t -123.85 135.69 62.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 165.193 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 55.9 mt -138.7 143.06 33.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 -168.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 44.4 t60 -68.18 -49.25 62.11 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.812 -0.555 . . . . 0.0 110.037 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -160.07 145.11 14.98 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.628 1.571 . . . . 0.0 107.088 171.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.5 150.37 47.24 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 167.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -60.49 -40.64 92.05 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.578 0.351 . . . . 0.0 110.832 178.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -161.46 178.25 9.31 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.248 1.419 . . . . 0.0 108.886 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -32.94 63.51 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.915 0.886 . . . . 0.0 113.057 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -76.83 -42.67 39.41 Favored 'General case' 0 C--N 1.339 0.13 0 CA-C-N 119.842 1.201 . . . . 0.0 109.499 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -64.81 -29.06 70.0 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.976 0.353 . . . . 0.0 110.602 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.73 98.25 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.373 -0.83 . . . . 0.0 111.313 173.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.7 mt -67.0 -43.52 89.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -59.14 -47.21 86.13 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.403 0.547 . . . . 0.0 111.081 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -66.19 -20.89 66.27 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.069 0.85 . . . . 0.0 112.844 176.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.9 m -79.47 -8.24 58.99 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.223 0.919 . . . . 0.0 112.181 172.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.2 mmt -131.31 -24.74 2.27 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.9 0.88 . . . . 0.0 112.731 -166.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -58.99 -36.91 64.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 119.216 0.917 . . . . 0.0 111.383 -171.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -66.54 -24.48 66.38 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.61 -0.682 . . . . 0.0 112.819 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.2 mt -85.22 -41.23 15.8 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.871 0.869 . . . . 0.0 109.118 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.0 tp -58.81 -40.29 83.68 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.096 0.958 . . . . 0.0 110.61 175.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -62.5 -26.19 68.41 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.731 1.213 . . . . 0.0 112.935 -176.37 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -108.08 14.73 24.89 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.367 0.667 . . . . 0.0 110.738 176.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.254 10.8 p30 45.24 41.97 6.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.361 1.865 . . . . 0.0 113.698 -172.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -64.06 -22.29 66.87 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.973 -1.079 . . . . 0.0 110.766 159.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.6 pt -143.45 163.5 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 126.301 1.84 . . . . 0.0 109.011 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.1 m -97.56 163.73 12.73 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.979 1.712 . . . . 0.0 109.274 166.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -57.51 -35.47 70.3 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.598 0.759 . . . . 0.0 112.318 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -58.9 -30.65 67.96 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.143 0.577 . . . . 0.0 112.206 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.74 -45.06 93.36 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.166 0.587 . . . . 0.0 110.244 -179.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.457 ' H ' HD12 ' A' ' 43' ' ' ILE . 4.5 mp -64.1 -47.31 90.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -64.73 -31.02 72.06 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.62 -0.705 . . . . 0.0 111.567 -174.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.55 -42.24 96.18 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.211 0.914 . . . . 0.0 111.16 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 19.1 mt -67.11 -46.27 84.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.45 -49.31 77.77 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.248 0.476 . . . . 0.0 110.079 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.93 -41.65 99.55 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 123.234 0.614 . . . . 0.0 111.011 -177.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 28.0 m -64.68 -40.93 96.25 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.692 0.397 . . . . 0.0 111.228 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 89.5 m . . . . . 0 N--CA 1.452 -0.349 0 C-N-CA 123.866 0.866 . . . . 0.0 109.784 178.035 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 . . . . . 0 C--O 1.232 0.173 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.5 mm -112.62 131.1 65.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 104.945 -2.242 . . . . 0.0 104.945 169.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -116.71 -27.17 6.74 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 122.784 0.434 . . . . 0.0 111.464 -168.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.05 161.39 29.58 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 125.53 1.532 . . . . 0.0 107.158 174.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -47.91 115.63 1.57 Allowed 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.11 2.54 . . . . 0.0 111.085 170.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.52 3.66 71.43 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 117.928 -1.484 . . . . 0.0 114.508 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.1 t -129.95 127.25 63.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 119.781 1.79 . . . . 0.0 109.563 -169.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.29 168.8 17.91 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.069 1.347 . . . . 0.0 110.915 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.2 ttm -140.99 73.26 27.18 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 123.622 0.769 . . . . 0.0 110.947 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -50.38 122.68 9.85 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.991 2.46 . . . . 0.0 112.774 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -163.39 155.06 17.28 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.176 1.791 . . . . 0.0 107.471 -175.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.61 165.86 25.82 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.329 1.452 . . . . 0.0 108.077 171.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -60.63 153.25 63.23 Favored Pre-proline 0 N--CA 1.469 0.523 0 O-C-N 121.272 -0.892 . . . . 0.0 109.876 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -46.9 -46.75 17.86 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.218 2.612 . . . . 0.0 113.048 176.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -66.99 -11.05 55.79 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.601 1.16 . . . . 0.0 113.867 -177.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 80.8 m -74.39 -11.59 60.29 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.646 1.112 . . . . 0.0 112.355 172.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 136.42 24.23 0.5 Allowed Glycine 0 CA--C 1.526 0.735 0 CA-C-O 118.71 -1.05 . . . . 0.0 113.86 171.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.32 155.39 38.24 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 119.547 1.674 . . . . 0.0 109.069 168.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.8 mt -132.86 -25.78 1.82 Allowed 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.796 1.239 . . . . 0.0 111.063 -174.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -145.88 -168.72 3.06 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.652 1.981 . . . . 0.0 106.85 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 41.0 m -125.45 126.79 45.48 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.363 0.665 . . . . 0.0 109.582 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.37 -176.23 40.98 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.046 0.831 . . . . 0.0 111.73 -176.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 62.1 mtt -143.71 168.47 19.82 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.562 1.545 . . . . 0.0 111.401 -176.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.3 m -138.21 168.7 19.18 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.385 1.874 . . . . 0.0 108.478 171.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.4 tp -151.45 120.84 6.84 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.95 1.7 . . . . 0.0 107.425 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 42.4 m -136.17 129.02 31.07 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.8 tp -117.56 136.67 53.11 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 175.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.3 mp -115.48 116.15 27.72 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -59.41 -39.88 84.87 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.637 0.653 . . . . 0.0 111.621 -175.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -102.36 -2.31 29.16 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.38 0.672 . . . . 0.0 112.309 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 65.85 -175.05 18.5 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.198 0.904 . . . . 0.0 113.674 -176.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -150.59 149.03 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 167.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -86.67 119.27 26.73 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 172.508 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo . . . . . 0 N--CA 1.457 -0.646 0 CA-C-O 121.657 0.607 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 48.4 mm -88.39 135.73 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 177.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -109.86 -25.04 10.53 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.742 0.817 . . . . 0.0 111.487 172.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 55.4 tp -127.98 126.51 41.51 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -169.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mp -133.28 139.27 46.82 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 -178.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.472 HD12 HD21 ' A' ' 122' ' ' LEU . 4.7 mt -125.49 123.62 65.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 173.188 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.99 155.48 36.75 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 176.223 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -149.99 138.73 20.85 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 176.066 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 54.3 p -139.11 155.45 47.88 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.107 1.363 . . . . 0.0 108.815 164.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.57 140.79 22.22 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.485 0.714 . . . . 0.0 109.634 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.23 -16.99 59.71 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 179.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -154.4 154.81 33.89 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.645 1.178 . . . . 0.0 109.221 -173.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.46 -35.36 73.92 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.62 0.768 . . . . 0.0 112.79 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.52 -38.55 74.28 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 119.474 1.034 . . . . 0.0 110.429 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.1 m -63.55 -38.23 90.36 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.172 0.589 . . . . 0.0 110.31 173.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -59.45 -49.23 78.62 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.096 172.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.4 mm -58.97 -46.08 91.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 119.557 1.072 . . . . 0.0 109.876 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.06 -46.64 93.45 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-N 118.846 0.748 . . . . 0.0 111.342 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.08 -46.36 89.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.419 0.688 . . . . 0.0 111.232 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.3 mm -56.62 -51.95 59.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -59.14 -33.87 71.39 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 118.782 -0.628 . . . . 0.0 111.419 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -64.92 -56.31 14.08 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.764 0.711 . . . . 0.0 110.489 173.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . 0.275 1.4 pp -71.3 -17.41 62.46 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 -174.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.5 m -60.07 -27.28 66.84 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 120.155 1.343 . . . . 0.0 111.607 170.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.08 -12.29 49.08 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.026 0.83 . . . . 0.0 111.801 175.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 69.6 mt -111.78 -51.52 2.85 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.397 1.079 . . . . 0.0 109.428 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.472 HD21 HD12 ' A' ' 101' ' ' ILE . 13.6 mt -73.45 -19.95 60.83 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -170.064 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.4 m -108.95 21.02 17.76 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.92 0.888 . . . . 0.0 110.758 -177.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -128.04 100.04 5.72 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.44 -28.62 63.49 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.687 0.795 . . . . 0.0 112.599 -175.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.31 -39.17 93.37 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.137 0.575 . . . . 0.0 110.386 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.71 -40.29 47.07 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.1 mt -57.7 -43.94 85.54 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.997 0.817 . . . . 0.0 110.615 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -57.83 -51.45 69.54 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.457 0.571 . . . . 0.0 110.05 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -65.05 -33.35 75.83 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.732 0.413 . . . . 0.0 112.087 -175.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 63.3 mt -68.06 -47.37 68.51 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 173.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.0 mt -64.22 -34.87 79.08 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 118.891 -0.576 . . . . 0.0 111.743 -176.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 63.8 p -87.49 -0.66 57.15 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.088 0.858 . . . . 0.0 112.343 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.42 118.19 5.3 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.368 0.985 . . . . 0.0 111.23 -171.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.6 m -73.05 -20.17 61.03 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.174 0.59 . . . . 0.0 112.272 -177.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.5 p -155.68 164.65 38.32 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.592 0.71 . . . . 0.0 110.832 -170.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.09 -30.94 66.64 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.786 0.834 . . . . 0.0 110.528 170.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.0 tptt -64.61 -44.01 91.94 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.47 0.577 . . . . 0.0 110.53 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -67.55 -37.95 83.43 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.258 0.481 . . . . 0.0 110.225 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 56.0 mt -60.59 -45.85 92.43 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.331 0.514 . . . . 0.0 110.357 173.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.81 92.63 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.562 0.745 . . . . 0.0 111.637 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -56.52 -42.45 78.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.759 0.709 . . . . 0.0 110.995 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 70.9 mt -66.78 -35.02 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 122.98 0.512 . . . . 0.0 109.782 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 26.4 mm -64.68 -49.55 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 119.143 0.883 . . . . 0.0 109.316 172.331 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 38.4 m -59.03 -30.54 68.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.102 0.865 . . . . 0.0 112.392 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -65.93 -22.1 66.47 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.272 1.029 . . . . 0.0 112.415 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.945 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 -178.845 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 tpt . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.738 0.304 . . . . 0.0 110.946 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -68.99 109.48 3.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 169.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.18 -44.29 83.43 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.351 1.06 . . . . 0.0 109.81 -172.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.07 -23.43 20.22 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.723 1.209 . . . . 0.0 112.682 -175.29 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -58.94 -28.41 66.23 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.776 0.716 . . . . 0.0 111.981 176.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -92.48 -13.29 30.13 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 117.911 -1.043 . . . . 0.0 112.66 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -112.67 85.33 7.36 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 120.974 1.715 . . . . 0.0 107.215 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.58 -59.52 1.16 Allowed 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 123.724 2.949 . . . . 0.0 115.464 -169.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.483 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.8 tp10 -161.62 -77.02 0.05 Allowed 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 118.677 0.672 . . . . 0.0 112.271 -178.394 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -68.61 13.62 0.09 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.109 1.764 . . . . 0.0 111.843 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 9' ' ' GLU . 5.5 m -75.65 8.7 2.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 128.508 2.723 . . . . 0.0 113.452 -168.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.4 mm -135.82 134.73 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 104.491 -2.411 . . . . 0.0 104.491 -169.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 75.7 m -155.33 147.31 23.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 118.83 0.741 . . . . 0.0 110.454 174.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 77.4 t -124.06 136.19 61.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 103.866 -2.642 . . . . 0.0 103.866 169.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 37.6 mt -139.0 147.86 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 N-CA-C 105.159 -2.163 . . . . 0.0 105.159 -169.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -66.87 -42.69 85.19 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.389 -0.819 . . . . 0.0 110.714 175.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -167.4 145.7 4.81 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.41 155.19 36.63 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -60.26 -40.12 89.21 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 176.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -167.84 -177.06 3.29 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 128.019 2.528 . . . . 0.0 107.521 172.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -61.76 -33.78 74.69 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 177.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.484 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.7 mt-30 -59.75 -51.48 69.58 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.621 1.555 . . . . 0.0 107.433 172.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -60.57 -34.55 74.35 Favored 'General case' 0 C--O 1.223 -0.337 0 O-C-N 121.646 -0.659 . . . . 0.0 111.521 177.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.5 73.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.629 -0.67 . . . . 0.0 110.883 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.94 -47.47 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 171.694 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.68 -45.45 81.74 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.743 -0.598 . . . . 0.0 110.557 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -68.57 -17.46 64.14 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 118.048 -0.977 . . . . 0.0 112.64 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.9 m -80.25 -17.61 51.74 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 120.866 1.666 . . . . 0.0 111.87 169.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.8 mmt -125.0 -18.44 5.49 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -169.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.4 -36.23 62.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-N 120.437 1.471 . . . . 0.0 111.734 -169.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.8 m -63.15 -22.34 66.8 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.757 0.708 . . . . 0.0 112.269 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 80.7 mt -89.91 -41.68 11.65 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.24 1.016 . . . . 0.0 109.125 174.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -55.36 -42.15 73.52 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.61 0.764 . . . . 0.0 110.576 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.75 -24.26 66.19 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 125.816 1.646 . . . . 0.0 114.102 -171.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -111.01 21.96 15.84 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.029 0.377 . . . . 0.0 110.422 172.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 54.84 34.19 21.46 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.996 1.318 . . . . 0.0 113.166 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -68.37 -22.12 64.68 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 120.583 -1.323 . . . . 0.0 109.71 168.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.1 pt -142.2 174.69 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 126.74 2.016 . . . . 0.0 108.557 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 m -112.24 159.9 18.15 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 126.471 1.908 . . . . 0.0 107.813 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.2 -31.22 69.95 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.24 -0.913 . . . . 0.0 112.337 -174.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -58.09 -32.48 68.11 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.052 0.541 . . . . 0.0 112.004 175.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -61.13 -44.13 97.81 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.358 0.663 . . . . 0.0 110.48 -177.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.406 ' H ' HD12 ' A' ' 43' ' ' ILE . 4.2 mp -59.17 -50.13 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 174.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -69.37 -25.01 63.96 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.437 -0.792 . . . . 0.0 112.142 -175.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.56 98.99 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 119.699 1.136 . . . . 0.0 110.627 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.0 mt -68.4 -45.53 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.484 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.3 mttt -60.73 -41.08 94.61 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.382 0.537 . . . . 0.0 110.096 -178.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -65.15 -38.76 91.62 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.892 0.877 . . . . 0.0 111.41 177.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -63.05 -36.7 84.44 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.652 -0.655 . . . . 0.0 110.376 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.6 m . . . . . 0 CA--C 1.54 0.583 0 C-N-CA 124.04 0.936 . . . . 0.0 110.664 176.315 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 . . . . . 0 N--CA 1.449 -0.498 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.2 mm -138.59 140.88 38.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mp -132.58 -27.91 1.68 Allowed 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -169.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.2 160.88 24.22 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.77 114.42 1.36 Allowed 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.728 2.285 . . . . 0.0 111.15 174.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.39 12.5 72.85 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 118.137 -1.368 . . . . 0.0 114.19 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.86 127.15 63.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-N 119.722 1.761 . . . . 0.0 108.827 -174.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.71 169.46 12.52 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.61 1.564 . . . . 0.0 109.809 179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.418 ' CE ' HD13 ' A' ' 118' ' ' LEU . 14.5 ttm -143.51 67.98 16.69 Favored Pre-proline 0 CA--C 1.536 0.436 0 O-C-N 121.926 -0.484 . . . . 0.0 111.295 176.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.06 149.4 53.27 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 121.297 1.331 . . . . 0.0 113.066 -174.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 174.15 153.44 0.11 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 128.582 2.753 . . . . 0.0 106.28 -169.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.85 166.1 24.09 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 125.988 1.715 . . . . 0.0 106.903 172.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -52.71 147.86 14.36 Favored Pre-proline 0 CA--C 1.536 0.421 0 CA-C-O 118.526 -0.749 . . . . 0.0 109.352 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -47.44 -42.13 28.65 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.794 2.33 . . . . 0.0 112.281 174.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -62.77 -13.8 37.37 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.491 1.116 . . . . 0.0 113.712 -177.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 71.6 m -78.28 -0.68 29.69 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.857 0.753 . . . . 0.0 111.827 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.54 15.03 2.26 Favored Glycine 0 C--N 1.336 0.53 0 CA-C-O 118.32 -1.267 . . . . 0.0 112.929 171.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.33 147.96 52.54 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 119.42 1.61 . . . . 0.0 109.549 169.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.1 mt -131.32 -33.5 1.48 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.519 1.128 . . . . 0.0 110.402 -174.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -145.5 156.69 43.87 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.516 1.527 . . . . 0.0 108.104 177.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.9 m -90.14 132.68 35.32 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 122.984 0.514 . . . . 0.0 110.365 -176.443 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.01 -176.17 43.08 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.739 1.161 . . . . 0.0 110.8 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 46.9 mtt -148.9 170.87 17.32 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.552 1.941 . . . . 0.0 110.284 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.42 162.67 40.12 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.085 1.754 . . . . 0.0 108.339 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.1 tp -146.42 122.45 10.74 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 126.207 1.803 . . . . 0.0 108.338 -172.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 74.2 m -137.25 143.79 42.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.373 1.069 . . . . 0.0 108.522 -171.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.2 tt -141.81 131.65 24.35 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 177.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -107.25 118.08 35.77 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 126.769 2.027 . . . . 0.0 107.018 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -59.49 -34.73 72.94 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.985 0.812 . . . . 0.0 112.45 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -96.67 -10.6 26.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.03 0.932 . . . . 0.0 112.097 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.73 179.97 11.88 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -169.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -149.23 161.38 5.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 169.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -109.02 118.02 35.72 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -169.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 . . . . . 0 CA--C 1.541 0.603 0 C-N-CA 123.798 0.839 . . . . 0.0 109.65 174.26 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 N--CA 1.455 -0.779 0 N-CA-C 110.204 -0.729 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 30.6 mm -85.9 135.43 25.01 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -110.04 -16.35 13.83 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.379 -1.296 . . . . 0.0 111.069 172.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 40.7 tp -147.79 135.04 20.53 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 120.409 1.459 . . . . 0.0 110.429 -169.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.7 mp -138.99 136.99 35.96 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.307 1.043 . . . . 0.0 109.061 -172.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 4.0 mt -116.72 115.42 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.051 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 168.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.81 152.52 40.83 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 171.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.494 HD23 ' N ' ' A' ' 104' ' ' SER . 0.5 OUTLIER -144.32 137.83 27.45 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 104.856 -2.276 . . . . 0.0 104.856 169.703 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.494 ' N ' HD23 ' A' ' 103' ' ' LEU . 92.1 p -129.99 148.03 51.8 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.047 1.739 . . . . 0.0 107.412 169.159 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.84 136.6 23.13 Favored 'General case' 0 CA--C 1.513 -0.474 0 O-C-N 121.625 -0.672 . . . . 0.0 109.671 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.22 -21.35 60.66 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 123.525 0.515 . . . . 0.0 111.628 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -143.92 153.0 41.84 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.863 0.865 . . . . 0.0 109.738 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.43 -33.37 71.17 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -77.61 -31.04 52.64 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.306 0.957 . . . . 0.0 111.236 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.5 m -63.53 -37.99 89.42 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.901 -0.499 . . . . 0.0 109.701 169.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -47.7 84.37 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.191 0.996 . . . . 0.0 110.219 171.349 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.0 mm -58.38 -50.62 78.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.03 -39.2 93.99 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-N 119.115 0.871 . . . . 0.0 111.93 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.12 -52.66 32.31 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.567 1.147 . . . . 0.0 110.567 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.0 mm -50.81 -47.34 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 125.508 1.523 . . . . 0.0 108.671 173.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -66.55 -9.45 35.1 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.974 -1.079 . . . . 0.0 112.542 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -93.87 -48.5 6.25 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 124.204 1.002 . . . . 0.0 109.626 169.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.548 HD12 ' N ' ' A' ' 119' ' ' SER . 1.1 pp -72.39 -24.38 61.24 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 113.313 0.856 . . . . 0.0 113.313 -173.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' SER . . . . . 0.548 ' N ' HD12 ' A' ' 118' ' ' LEU . 10.3 p -66.11 -21.69 66.36 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 123.124 0.57 . . . . 0.0 111.457 172.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -67.0 -21.25 65.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.246 0.93 . . . . 0.0 109.849 172.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 24.8 mt -96.82 -71.21 0.69 Allowed 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.12 0.968 . . . . 0.0 110.783 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 20.0 mt -69.06 -13.33 62.38 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 -169.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 31.2 m -100.22 27.26 5.77 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 120.243 1.383 . . . . 0.0 111.522 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -128.88 110.46 12.14 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.625 1.97 . . . . 0.0 106.104 172.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -60.24 -26.63 66.59 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.863 0.465 . . . . 0.0 111.453 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -62.93 -47.49 82.99 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 123.619 0.768 . . . . 0.0 109.676 175.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -65.52 -44.16 94.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 123.982 0.913 . . . . 0.0 109.092 176.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 48.2 mt -56.12 -43.39 78.12 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 118.632 0.651 . . . . 0.0 111.487 -175.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -67.74 -40.47 84.15 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 118.052 0.387 . . . . 0.0 110.462 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.424 ' HB3' HD11 ' A' ' 143' ' ' ILE . 44.0 mt-30 -69.64 -33.08 72.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 118.749 0.704 . . . . 0.0 110.214 -176.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 19.1 mt -68.3 -56.77 7.43 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 170.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 35.7 mt -55.41 -26.22 40.47 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -173.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 74.4 p -101.57 6.78 42.31 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.402 1.081 . . . . 0.0 112.338 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.31 112.7 1.65 Allowed 'General case' 0 C--N 1.342 0.264 0 C-N-CA 124.845 1.258 . . . . 0.0 110.493 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 7.4 m -70.0 -24.81 63.36 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.253 0.621 . . . . 0.0 112.054 177.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 15.5 m -150.59 158.97 44.77 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.111 0.964 . . . . 0.0 110.16 -169.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -51.15 -39.34 56.08 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.949 1.7 . . . . 0.0 111.1 176.117 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -57.25 -35.36 69.63 Favored 'General case' 0 C--O 1.227 -0.103 0 C-N-CA 123.13 0.572 . . . . 0.0 112.384 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -80.44 -27.71 37.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 119.426 1.012 . . . . 0.0 110.413 -177.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 27.4 mt -66.15 -50.44 63.93 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.526 1.057 . . . . 0.0 108.387 170.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.12 -33.75 67.68 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.934 0.894 . . . . 0.0 113.15 174.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.76 -42.53 99.73 Favored 'General case' 0 N--CA 1.463 0.177 0 O-C-N 121.209 -0.932 . . . . 0.0 110.868 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.424 HD11 ' HB3' ' A' ' 130' ' ' GLN . 96.6 mt -69.15 -35.41 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.1 mm -58.26 -53.82 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 169.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 24.7 m -63.96 -27.0 68.84 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 122.68 0.392 . . . . 0.0 111.578 -170.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -59.82 -27.38 66.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.663 1.585 . . . . 0.0 113.404 175.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.851 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 -174.64 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.486 1.354 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -67.05 112.39 4.36 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 104.873 -2.269 . . . . 0.0 104.873 168.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -48.53 -43.51 35.43 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.983 0.913 . . . . 0.0 110.377 -176.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.42 -24.36 1.94 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.685 1.994 . . . . 0.0 113.902 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -59.42 -26.85 65.51 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.291 0.951 . . . . 0.0 112.337 177.25 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -100.44 -15.86 17.77 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.098 0.959 . . . . 0.0 112.902 -174.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -103.09 98.32 11.52 Favored Pre-proline 0 N--CA 1.471 0.624 0 CA-C-N 120.879 1.672 . . . . 0.0 106.985 -173.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.5 -60.43 0.31 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.696 2.264 . . . . 0.0 113.434 -171.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.408 ' C ' ' H ' ' A' ' 11' ' ' SER . 54.9 tt0 -165.97 -87.02 0.02 OUTLIER 'General case' 0 C--O 1.232 0.157 0 C-N-CA 123.592 0.757 . . . . 0.0 111.621 -170.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.2 m -67.87 8.76 0.35 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.337 1.455 . . . . 0.0 111.754 176.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.408 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -65.63 -25.54 67.42 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.99 1.316 . . . . 0.0 111.905 -174.926 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.2 mp -98.23 140.0 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.975 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.0 m -154.39 158.36 39.91 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.483 0.659 . . . . 0.0 110.606 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.5 t -128.33 145.46 35.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 173.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mm -138.76 140.04 39.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 104.654 -2.351 . . . . 0.0 104.654 -169.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -71.34 -49.52 41.63 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 119.269 0.941 . . . . 0.0 109.303 171.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.0 p -159.4 144.24 15.48 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.5 156.87 25.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 169.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.7 ttpt -58.75 -42.07 87.99 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.878 0.471 . . . . 0.0 110.653 175.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -165.22 177.69 7.46 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 128.212 2.605 . . . . 0.0 107.214 173.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.81 -37.07 65.65 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.227 1.811 . . . . 0.0 114.036 175.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.403 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.6 mt-30 -62.6 -50.35 71.6 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 120.401 1.455 . . . . 0.0 108.687 173.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -60.55 -32.45 71.52 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 122.951 0.5 . . . . 0.0 111.416 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.36 -37.86 86.27 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 121.575 -0.703 . . . . 0.0 110.158 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.51 -47.28 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 170.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -58.03 -49.64 76.15 Favored 'General case' 0 C--N 1.334 -0.082 0 C-N-CA 123.222 0.609 . . . . 0.0 110.657 -174.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -62.82 -28.69 70.18 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.568 1.147 . . . . 0.0 111.626 174.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.2 m -76.51 -15.18 59.94 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.718 1.145 . . . . 0.0 112.766 177.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.94 -12.49 4.7 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -171.06 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -55.75 -34.19 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 120.525 1.511 . . . . 0.0 112.069 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.9 m -66.84 -41.61 87.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.385 -0.822 . . . . 0.0 110.253 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -65.74 -38.45 89.15 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 46.2 tp -60.65 -49.86 75.82 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.534 0.734 . . . . 0.0 110.316 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -64.92 -33.2 75.45 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.398 1.079 . . . . 0.0 112.221 -176.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -79.86 -0.37 34.47 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.654 1.182 . . . . 0.0 111.876 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 53.82 32.07 14.29 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.24 1.816 . . . . 0.0 113.284 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -68.31 -24.88 64.89 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 120.819 -1.175 . . . . 0.0 109.709 168.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.6 pt -144.07 168.72 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 126.235 1.814 . . . . 0.0 110.016 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.3 p -96.11 172.56 7.91 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.807 1.243 . . . . 0.0 109.845 169.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.27 -33.05 74.49 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.267 -0.896 . . . . 0.0 110.557 171.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -61.27 -40.25 93.41 Favored 'General case' 0 C--N 1.342 0.251 0 O-C-N 121.97 -0.456 . . . . 0.0 110.684 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -54.28 -49.48 69.49 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.009 0.524 . . . . 0.0 110.154 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 45.2 mt -59.72 -49.2 84.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 C-N-CA 123.644 0.778 . . . . 0.0 109.246 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -68.5 -26.87 65.68 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.165 -0.921 . . . . 0.0 111.995 -174.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.95 83.29 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.566 1.076 . . . . 0.0 110.683 171.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.06 -51.72 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.403 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.9 mttt -58.52 -44.03 89.36 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -175.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -64.28 -46.24 84.54 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.774 0.83 . . . . 0.0 111.275 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.0 m -64.05 -35.79 81.88 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.801 0.44 . . . . 0.0 110.76 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 96.8 m . . . . . 0 N--CA 1.449 -0.495 0 C-N-CA 123.746 0.818 . . . . 0.0 109.827 177.891 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 . . . . . 0 N--CA 1.452 -0.328 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 26.3 mm -137.04 140.03 43.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 102.643 -3.095 . . . . 0.0 102.643 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.586 HD12 HG12 ' A' ' 63' ' ' VAL . 30.7 mt -110.39 -40.46 4.64 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -168.224 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -168.38 165.03 7.82 Favored Pre-proline 0 C--O 1.236 0.384 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -169.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -47.92 113.03 0.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.827 2.351 . . . . 0.0 110.756 169.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.16 5.78 75.99 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 117.81 -1.55 . . . . 0.0 114.848 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.586 HG12 HD12 ' A' ' 59' ' ' LEU . 19.0 t -135.3 133.95 52.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-N 120.92 2.36 . . . . 0.0 109.524 -171.291 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.65 166.77 21.84 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.786 1.635 . . . . 0.0 110.281 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.525 ' HB2' HD11 ' A' ' 59' ' ' LEU . 33.5 ttp -147.5 82.44 8.13 Favored Pre-proline 0 C--O 1.225 -0.195 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 170.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -58.76 -91.21 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.312 0 C-N-CA 123.036 2.491 . . . . 0.0 114.43 -174.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . 0.301 0.2 OUTLIER 47.78 178.18 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.578 2.351 . . . . 0.0 114.753 -168.983 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.7 167.94 19.92 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 125.281 1.432 . . . . 0.0 107.848 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 25.1 mtm105 -60.74 150.57 75.61 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-O 118.575 -0.726 . . . . 0.0 109.046 174.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -45.63 -45.14 16.73 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.634 2.889 . . . . 0.0 112.755 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -61.71 -15.55 41.48 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.219 1.408 . . . . 0.0 113.643 -176.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.5 m -79.63 -4.72 52.91 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.518 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 131.49 18.64 1.27 Allowed Glycine 0 CA--C 1.523 0.579 0 CA-C-O 118.943 -0.92 . . . . 0.0 113.591 174.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.0 144.2 56.34 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 119.087 1.443 . . . . 0.0 107.645 169.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.9 mt -123.69 -32.63 3.3 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 124.313 1.045 . . . . 0.0 110.158 -173.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -143.19 170.85 14.97 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.415 1.886 . . . . 0.0 107.468 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 97.5 m -103.17 122.23 44.28 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.464 0.706 . . . . 0.0 110.381 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.11 -177.23 38.65 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 126.017 1.77 . . . . 0.0 111.052 -175.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.607 ' SD ' HD21 ' A' ' 118' ' ' LEU . 51.4 mtt -149.15 169.83 19.82 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.594 1.697 . . . . 0.0 112.065 -171.332 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.9 p -146.86 168.08 22.32 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.859 1.264 . . . . 0.0 109.793 174.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.555 HD22 HD11 ' A' ' 144' ' ' ILE . 24.5 tp -153.98 106.78 2.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.797 1.639 . . . . 0.0 106.795 -172.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 65.5 m -122.7 140.9 52.36 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 123.79 0.836 . . . . 0.0 108.77 -169.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.4 tt -133.67 130.47 38.26 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.3 mp -110.32 119.45 39.28 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.744 1.617 . . . . 0.0 107.924 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -63.1 -36.15 82.62 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.588 0.631 . . . . 0.0 112.178 -177.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -91.05 -17.1 26.79 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.811 1.245 . . . . 0.0 111.919 177.113 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 68.1 -179.93 18.18 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -168.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.74 162.94 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 169.178 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -121.09 83.82 2.14 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 122.295 1.045 . . . . 0.0 110.605 -169.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 CA--C 1.538 0.507 0 CA-C-N 114.317 -1.31 . . . . 0.0 112.212 174.142 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo . . . . . 0 N--CA 1.456 -0.715 0 CA-C-O 121.546 0.561 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 47.5 mm -112.43 136.95 47.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 C-N-CA 124.735 1.214 . . . . 0.0 107.876 -171.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -113.74 -9.71 13.12 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 117.192 -1.385 . . . . 0.0 110.973 175.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.9 mt -136.37 138.94 42.12 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 120.582 1.537 . . . . 0.0 111.309 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.5 mp -137.02 101.46 4.57 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.428 HG21 HD22 ' A' ' 118' ' ' LEU . 1.7 mp -77.05 146.43 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 169.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.06 23.68 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 109.035 -1.626 . . . . 0.0 109.035 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.519 HD23 ' N ' ' A' ' 104' ' ' SER . 1.1 tt -155.04 150.0 26.79 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 -171.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.519 ' N ' HD23 ' A' ' 103' ' ' LEU . 11.0 p -143.0 141.95 31.48 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 127.226 2.211 . . . . 0.0 105.084 169.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -149.23 130.22 14.37 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -173.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.29 -22.96 57.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 123.399 0.437 . . . . 0.0 111.428 -175.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -139.41 155.76 47.42 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.778 0.831 . . . . 0.0 110.32 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.87 -34.24 71.4 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.684 0.793 . . . . 0.0 112.973 -177.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -77.28 -32.16 55.34 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.1 0.864 . . . . 0.0 111.102 177.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.3 m -60.48 -41.7 94.78 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 169.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.36 -47.3 84.24 Favored 'General case' 0 C--O 1.225 -0.21 0 C-N-CA 124.68 1.192 . . . . 0.0 110.71 173.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 15.1 mm -59.69 -53.03 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -63.14 -37.04 94.27 Favored Glycine 0 CA--C 1.528 0.891 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 -177.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.432 ' CB ' HD21 ' A' ' 103' ' ' LEU . . . -66.0 -50.77 63.11 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.641 1.177 . . . . 0.0 110.53 177.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 mm -54.71 -45.54 73.19 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -71.28 -10.32 59.56 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.674 0.79 . . . . 0.0 113.056 -177.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.23 -42.5 14.62 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 169.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.607 HD21 ' SD ' ' A' ' 79' ' ' MET . 83.8 mt -63.77 -32.99 74.67 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 117.804 -1.093 . . . . 0.0 110.2 178.43 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 13.8 m -51.17 -28.88 12.23 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 171.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -67.9 -22.82 65.06 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.634 1.106 . . . . 0.0 110.845 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 49.6 mt -108.03 -60.81 1.67 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.744 1.218 . . . . 0.0 109.874 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.498 HD13 HD13 ' A' ' 59' ' ' LEU . 0.1 OUTLIER -52.14 -38.73 58.48 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 127.679 2.392 . . . . 0.0 114.19 178.098 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 56.5 m -95.06 24.99 4.45 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.481 1.037 . . . . 0.0 111.664 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -133.32 101.91 5.35 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 124.101 0.96 . . . . 0.0 108.808 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -58.16 -28.55 64.83 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.801 -179.065 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.35 -43.15 91.75 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.278 0.631 . . . . 0.0 110.049 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.56 -44.4 86.44 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.8 mt -56.29 -37.88 70.47 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 119.101 0.864 . . . . 0.0 111.319 -176.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -68.35 -40.33 81.57 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 118.907 0.776 . . . . 0.0 111.109 175.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -69.03 -34.76 75.75 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 118.797 0.726 . . . . 0.0 109.805 -177.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -65.96 -55.15 18.3 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 169.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 35.0 mt -56.19 -16.11 4.79 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.901 1.075 . . . . 0.0 113.901 -176.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 42.8 p -112.0 7.62 19.91 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.95 1.3 . . . . 0.0 110.806 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.49 117.78 6.16 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.631 1.572 . . . . 0.0 110.348 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 19.8 m -76.99 -15.36 59.66 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.721 0.808 . . . . 0.0 112.157 175.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 73.5 p -154.92 164.65 38.56 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 119.035 0.834 . . . . 0.0 110.986 -170.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -58.09 -37.11 73.88 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.856 0.862 . . . . 0.0 109.494 169.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -57.91 -45.53 86.35 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 122.659 0.384 . . . . 0.0 110.455 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.68 -33.87 76.9 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.3 mt -67.55 -51.49 50.14 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.065 0.848 . . . . 0.0 109.074 175.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.72 -24.4 67.76 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.096 0.958 . . . . 0.0 113.511 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -61.07 -44.67 97.02 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 120.712 -1.243 . . . . 0.0 109.776 172.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 89.9 mt -67.35 -35.51 73.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.166 0.986 . . . . 0.0 109.368 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ILE . . . . . 0.555 HD11 HD22 ' A' ' 81' ' ' LEU . 41.2 mm -56.22 -53.77 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 169.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 20.3 m -64.66 -33.02 74.95 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 123.642 0.589 . . . . 0.0 110.624 -171.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -58.51 -45.06 89.55 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.779 1.631 . . . . 0.0 112.707 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.038 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 -169.785 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 tpt . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -65.91 110.11 2.76 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 168.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.38 -41.11 65.58 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.618 0.767 . . . . 0.0 110.447 -175.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.4 p -53.26 -21.62 5.68 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.583 1.553 . . . . 0.0 113.549 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -59.82 -25.0 64.61 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.664 1.12 . . . . 0.0 112.264 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -100.72 -10.97 20.33 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 117.57 -1.205 . . . . 0.0 113.126 -174.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -113.78 83.32 7.3 Favored Pre-proline 0 N--CA 1.474 0.768 0 CA-C-N 121.52 1.964 . . . . 0.0 107.479 -174.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -55.74 -54.18 4.53 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.864 3.042 . . . . 0.0 116.277 -169.508 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.466 ' C ' ' H ' ' A' ' 11' ' ' SER . 42.0 tt0 -157.88 -93.34 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.573 0.624 . . . . 0.0 112.589 -169.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 m -68.52 13.43 0.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.432 1.493 . . . . 0.0 111.365 177.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.466 ' H ' ' C ' ' A' ' 9' ' ' GLU . 11.2 m -62.03 -29.17 70.1 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.448 1.499 . . . . 0.0 111.229 -169.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.3 mp -105.84 129.93 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 -175.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 31.1 m -144.2 141.56 29.97 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 123.388 0.43 . . . . 0.0 110.351 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.4 t -112.6 135.41 52.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 169.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.41 HG22 ' H ' ' A' ' 17' ' ' SER . 30.9 mt -136.75 145.52 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -169.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -59.4 -46.29 89.11 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.99 0.916 . . . . 0.0 111.82 174.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 15' ' ' ILE . 18.5 p -168.14 150.94 5.56 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.541 1.136 . . . . 0.0 108.161 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.21 144.26 30.8 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 168.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tppt? -72.32 -30.01 64.36 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 122.096 -0.378 . . . . 0.0 111.955 -175.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -163.81 173.18 13.1 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 127.388 2.275 . . . . 0.0 106.123 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -66.6 -33.95 76.8 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 119.252 -0.404 . . . . 0.0 110.504 169.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.412 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.4 mt-30 -59.06 -48.03 83.09 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 169.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -65.54 -33.56 76.21 Favored 'General case' 0 C--O 1.223 -0.292 0 O-C-N 121.788 -0.57 . . . . 0.0 111.52 -178.233 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.61 -37.77 88.6 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 121.81 -0.556 . . . . 0.0 109.686 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.1 -45.85 85.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.022 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -56.87 -44.95 82.75 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.035 0.534 . . . . 0.0 110.426 -174.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -67.62 -32.79 73.75 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 118.101 -0.952 . . . . 0.0 111.734 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.3 m -61.99 -21.16 64.61 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.64 1.109 . . . . 0.0 112.274 173.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.6 mmt -122.2 -23.94 5.2 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 -169.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -59.5 -34.57 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 120.912 1.687 . . . . 0.0 112.272 -170.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.1 m -63.1 -29.64 70.96 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.34 0.973 . . . . 0.0 111.723 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 71.5 mt -81.07 -40.66 23.8 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.153 0.981 . . . . 0.0 109.265 174.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.5 tp -56.58 -40.71 75.7 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.711 0.804 . . . . 0.0 110.628 177.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -66.54 -27.96 68.16 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 124.918 1.287 . . . . 0.0 113.068 -172.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -101.87 16.95 24.35 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 117.971 0.351 . . . . 0.0 110.486 173.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.423 0.0 OUTLIER 44.28 42.66 5.36 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.26 2.224 . . . . 0.0 115.807 -170.122 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -68.14 -19.29 64.81 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 120.974 -1.079 . . . . 0.0 110.193 168.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.9 pt -143.26 174.14 5.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 127.081 2.152 . . . . 0.0 108.125 -176.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 m -111.75 159.22 18.47 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.007 1.723 . . . . 0.0 107.722 171.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -60.99 -30.65 70.4 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.971 -1.08 . . . . 0.0 111.901 -176.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -57.97 -36.73 73.0 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.705 -0.622 . . . . 0.0 111.92 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -60.3 -45.11 94.51 Favored 'General case' 0 CA--C 1.527 0.09 0 C-N-CA 123.681 0.792 . . . . 0.0 110.015 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.8 mt -59.1 -51.05 77.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 124.725 1.21 . . . . 0.0 108.481 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.8 tp60 -67.97 -26.0 65.71 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.026 -0.988 . . . . 0.0 111.775 -175.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.33 -43.36 96.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 119.771 1.168 . . . . 0.0 110.658 173.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.2 mt -67.74 -48.81 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.4 mttt -59.34 -45.5 91.19 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.195 0.452 . . . . 0.0 109.841 -175.717 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.3 -42.78 96.21 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 124.222 1.009 . . . . 0.0 111.106 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.0 m -64.36 -42.9 95.97 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.135 0.425 . . . . 0.0 110.235 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 98.3 m . . . . . 0 CA--C 1.536 0.437 0 C-N-CA 124.573 1.149 . . . . 0.0 111.022 176.454 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.3 mm -125.65 127.02 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 103.713 -2.699 . . . . 0.0 103.713 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.9 mp -120.15 -21.99 6.8 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -169.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.56 159.36 31.72 Favored Pre-proline 0 C--O 1.236 0.368 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 170.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -62.24 104.83 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 121.682 1.588 . . . . 0.0 108.99 170.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.56 -10.04 16.68 Favored Glycine 0 CA--C 1.533 1.176 0 CA-C-O 117.958 -1.468 . . . . 0.0 113.973 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.8 t -132.91 123.06 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 119.632 1.716 . . . . 0.0 108.863 -170.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -117.73 167.17 11.61 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 126.114 1.766 . . . . 0.0 109.12 174.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.9 ttm -137.58 60.25 24.68 Favored Pre-proline 0 CA--C 1.548 0.888 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 177.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -53.53 141.79 61.63 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.262 1.975 . . . . 0.0 114.429 -172.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -175.75 156.66 1.88 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.552 2.741 . . . . 0.0 106.753 -171.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.62 162.03 33.86 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.863 1.665 . . . . 0.0 107.366 169.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -52.52 141.94 32.62 Favored Pre-proline 0 CA--C 1.537 0.454 0 CA-C-O 117.676 -1.154 . . . . 0.0 108.868 176.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -45.69 -41.13 19.29 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.818 3.012 . . . . 0.0 112.916 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -62.2 -13.06 23.73 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.465 1.506 . . . . 0.0 113.253 -177.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 62.1 m -78.25 -1.82 34.85 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.649 0.78 . . . . 0.0 111.583 177.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.41 17.46 2.4 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-O 118.433 -1.204 . . . . 0.0 112.96 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.58 145.83 55.58 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.3 1.55 . . . . 0.0 108.724 169.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.1 mt -128.46 -32.28 2.2 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 124.471 1.109 . . . . 0.0 110.425 -173.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -145.26 160.86 40.84 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.605 1.562 . . . . 0.0 108.438 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 82.2 m -94.54 127.76 40.7 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 123.195 0.598 . . . . 0.0 110.091 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -170.82 -176.45 40.12 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 125.204 1.383 . . . . 0.0 110.683 -175.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 49.2 mtt -148.26 171.81 15.36 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.095 1.758 . . . . 0.0 111.059 -174.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -139.15 168.25 20.25 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.131 1.773 . . . . 0.0 108.586 174.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.477 HD22 HD11 ' A' ' 144' ' ' ILE . 13.3 tp -148.77 83.31 1.46 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.699 2.0 . . . . 0.0 107.397 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 55.7 m -86.51 142.57 28.25 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 176.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.2 tt -136.59 116.9 13.58 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 169.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -89.1 132.24 34.89 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 172.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.06 -29.24 70.12 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 169.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -130.29 75.66 1.67 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.645 1.978 . . . . 0.0 107.331 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -52.12 161.45 2.17 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 125.949 1.738 . . . . 0.0 113.835 175.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 48.9 t -127.6 147.58 32.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 C-N-CA 125.745 1.618 . . . . 0.0 107.426 -173.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -98.65 179.14 4.77 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 . . . . . 0 C--N 1.323 -0.558 0 C-N-CA 124.162 0.985 . . . . 0.0 111.744 -169.664 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo . . . . . 0 N--CA 1.448 -1.17 0 N-CA-C 110.493 -0.618 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 49.6 mm -117.35 124.72 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -88.86 -33.34 17.38 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 117.178 -1.391 . . . . 0.0 109.434 169.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 mt -116.19 131.11 57.04 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-N 120.034 1.288 . . . . 0.0 112.025 -169.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mp -136.84 104.99 5.66 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.9 mp -87.51 112.34 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 175.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.18 153.88 47.15 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 172.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.43 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -147.27 133.97 19.97 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 169.176 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.43 ' N ' HD23 ' A' ' 103' ' ' LEU . 93.0 p -127.62 147.69 50.36 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 126.344 1.858 . . . . 0.0 106.925 168.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -147.25 132.87 18.79 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -178.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.16 -22.74 60.44 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.721 0.408 . . . . 0.0 111.962 179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -144.42 155.82 43.93 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.678 0.791 . . . . 0.0 110.036 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.36 74.87 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.22 -31.22 62.53 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 120.839 -1.163 . . . . 0.0 111.032 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.7 m -64.65 -39.05 93.01 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.937 -0.477 . . . . 0.0 110.136 170.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -58.84 -48.84 79.92 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 123.637 0.775 . . . . 0.0 109.873 172.331 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 16.0 mm -55.92 -53.83 33.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.25 -39.28 94.39 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 118.837 0.744 . . . . 0.0 112.03 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.96 -53.3 27.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.459 1.104 . . . . 0.0 110.582 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -51.35 -47.44 34.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.47 1.508 . . . . 0.0 108.637 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -67.62 -10.66 54.13 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.499 1.12 . . . . 0.0 112.555 -177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -93.87 -46.17 7.31 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 123.973 0.909 . . . . 0.0 109.726 169.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.465 HD12 ' N ' ' A' ' 119' ' ' SER . 1.8 pp -72.66 -25.24 61.19 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 118.711 0.687 . . . . 0.0 112.108 -173.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' SER . . . . . 0.465 ' N ' HD12 ' A' ' 118' ' ' LEU . 4.9 p -61.18 -20.91 63.29 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.177 0.591 . . . . 0.0 112.152 172.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -65.7 -19.17 65.8 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.391 0.996 . . . . 0.0 110.098 172.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 36.5 mt -106.54 -63.29 1.29 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.639 1.576 . . . . 0.0 110.178 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.5 -23.85 59.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.533 1.933 . . . . 0.0 114.528 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.0 m -112.48 28.15 9.03 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 118.95 0.796 . . . . 0.0 110.165 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -132.89 102.57 5.69 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.863 0.865 . . . . 0.0 108.903 177.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -57.85 -26.92 62.72 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.938 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -62.09 -45.0 95.45 Favored 'General case' 0 C--N 1.34 0.152 0 C-N-CA 123.893 0.877 . . . . 0.0 110.123 174.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -69.06 -46.35 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 CA-C-O 117.961 -1.019 . . . . 0.0 108.728 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 8.8 mp -50.56 -44.18 56.57 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 119.541 1.064 . . . . 0.0 112.672 -176.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -71.25 -34.38 70.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 118.63 0.65 . . . . 0.0 110.384 -178.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -72.76 -34.43 67.0 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 121.404 -0.81 . . . . 0.0 109.68 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 55.7 mt -65.6 -53.47 41.27 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.9 mt -56.78 -32.43 65.64 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -174.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 37.2 p -88.24 -0.53 57.22 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.076 0.95 . . . . 0.0 112.26 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.87 138.64 57.22 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 119.127 0.876 . . . . 0.0 110.178 176.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.0 m -124.57 9.07 8.35 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.943 1.297 . . . . 0.0 110.754 176.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 74.8 p -152.16 153.66 34.31 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.491 1.116 . . . . 0.0 108.916 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -62.21 -32.12 72.74 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -58.07 -40.99 82.42 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.191 0.597 . . . . 0.0 111.842 176.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 14.3 tp60 -74.56 -30.89 61.91 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 119.429 1.013 . . . . 0.0 110.738 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.77 -50.15 52.82 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.407 1.003 . . . . 0.0 108.924 173.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.36 -31.1 65.41 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.515 1.126 . . . . 0.0 112.892 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -61.93 -45.85 91.88 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 120.842 -1.161 . . . . 0.0 110.038 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 95.7 mt -65.49 -37.2 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 123.987 0.915 . . . . 0.0 109.739 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ILE . . . . . 0.477 HD11 HD22 ' A' ' 81' ' ' LEU . 40.2 mm -56.24 -49.56 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-N 118.23 0.468 . . . . 0.0 110.128 169.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 39.2 m -66.84 -26.26 66.83 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -169.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -67.41 -34.86 78.11 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.776 0.717 . . . . 0.0 111.252 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.926 0 CA-C-O 117.815 -1.547 . . . . 0.0 110.375 -169.257 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tpp . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.705 0.288 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.34 106.45 1.71 Allowed 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 169.039 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.4 -42.9 96.88 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 175.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -56.03 -24.04 36.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.41 1.084 . . . . 0.0 112.773 -178.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.81 -22.68 66.8 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.097 0.862 . . . . 0.0 112.688 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -106.0 -10.2 16.69 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-O 116.52 -1.705 . . . . 0.0 113.593 -170.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -115.47 91.01 27.34 Favored Pre-proline 0 N--CA 1.477 0.925 0 CA-C-N 122.729 2.513 . . . . 0.0 108.433 -174.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -42.07 -75.07 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.804 1 C-N-CA 125.537 4.158 . . . . 0.0 116.795 -171.022 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.472 ' C ' ' H ' ' A' ' 11' ' ' SER . 8.0 tp10 -162.09 -76.69 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 124.032 0.933 . . . . 0.0 111.114 -173.098 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.1 m -66.86 6.35 0.51 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.544 1.537 . . . . 0.0 111.803 175.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.472 ' H ' ' C ' ' A' ' 9' ' ' GLU . 3.8 m -74.91 1.52 12.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 128.452 2.701 . . . . 0.0 113.247 -169.04 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.5 mt -130.69 131.82 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 -172.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.5 p -151.61 155.6 38.73 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 122.052 0.929 . . . . 0.0 111.347 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -127.59 136.1 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 103.297 -2.853 . . . . 0.0 103.297 169.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.1 mt -134.89 147.39 29.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 106.46 -1.682 . . . . 0.0 106.46 -169.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -63.24 -47.93 80.37 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.938 -0.476 . . . . 0.0 110.631 174.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 p -166.51 147.42 6.23 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -172.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.15 149.89 30.39 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 169.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -60.19 -41.03 92.07 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.02 0.528 . . . . 0.0 110.818 178.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -166.02 179.9 5.55 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 127.09 2.156 . . . . 0.0 107.658 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -64.61 -31.6 72.89 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.021 0.929 . . . . 0.0 112.567 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.433 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.2 mt-30 -62.95 -49.43 74.76 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 120.265 1.393 . . . . 0.0 107.872 169.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.47 -34.77 74.51 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 121.887 -0.508 . . . . 0.0 111.67 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.63 -35.52 79.85 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.936 -0.478 . . . . 0.0 110.124 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -71.27 -45.85 68.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 172.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -55.58 -44.71 77.17 Favored 'General case' 0 C--O 1.225 -0.203 0 O-C-N 121.747 -0.596 . . . . 0.0 110.8 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -65.76 -33.35 75.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.753 174.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.5 m -63.32 -19.91 65.03 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.638 1.108 . . . . 0.0 112.479 172.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.8 mmt -124.68 -20.97 4.92 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -168.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -59.66 -36.99 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 120.788 1.631 . . . . 0.0 111.916 -169.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.3 m -66.57 -19.79 65.86 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.941 0.791 . . . . 0.0 112.183 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.9 mt -86.03 -44.44 12.3 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 123.927 0.891 . . . . 0.0 109.072 170.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -56.38 -42.92 78.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.959 0.904 . . . . 0.0 110.772 -178.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -67.59 -23.03 65.34 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 125.758 1.623 . . . . 0.0 113.942 -170.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -115.38 26.44 10.07 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 122.558 0.343 . . . . 0.0 110.454 171.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 60.89 27.15 17.0 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 170.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -67.21 -22.15 65.73 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.133 -0.979 . . . . 0.0 110.814 169.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 pt -143.35 170.27 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 126.165 1.786 . . . . 0.0 108.879 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.6 m -102.63 158.79 15.99 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.304 1.841 . . . . 0.0 108.385 171.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.29 -32.43 70.03 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.227 -0.92 . . . . 0.0 112.372 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -58.23 -32.83 68.7 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.764 -0.585 . . . . 0.0 111.954 175.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -60.74 -42.65 97.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.586 0.754 . . . . 0.0 110.435 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -59.69 -50.8 78.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -69.11 -27.58 65.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.59 -0.719 . . . . 0.0 111.915 -173.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.17 -40.98 78.39 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.016 0.826 . . . . 0.0 110.757 174.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.5 mt -72.6 -49.23 42.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.433 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 90.8 mttt -58.36 -41.24 84.27 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 119.448 -0.31 . . . . 0.0 110.443 -175.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -59.39 -52.74 64.32 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.463 0.705 . . . . 0.0 111.051 -173.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.5 m -64.64 -40.69 95.91 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.789 0.436 . . . . 0.0 110.481 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 CA--C 1.535 0.375 0 CA-C-O 119.098 -0.477 . . . . 0.0 111.671 178.273 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 . . . . . 0 N--CA 1.456 -0.151 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 50.2 mm -119.66 139.0 48.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 177.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mp -130.77 -25.18 2.35 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -169.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -158.5 161.86 27.74 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 173.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -48.64 118.38 3.34 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.775 2.317 . . . . 0.0 110.807 169.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.98 3.19 88.0 Favored Glycine 0 CA--C 1.533 1.199 0 CA-C-O 117.799 -1.556 . . . . 0.0 114.931 178.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 26.2 t -132.03 126.19 56.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-N 120.067 1.934 . . . . 0.0 108.882 -172.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.07 168.38 15.43 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.155 1.782 . . . . 0.0 109.768 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.45 ' CE ' HD11 ' A' ' 118' ' ' LEU . 5.4 ttm -137.31 60.41 26.97 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.035 0.934 . . . . 0.0 110.397 175.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -57.13 123.57 14.14 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 121.911 1.741 . . . . 0.0 110.362 -174.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.54 161.41 3.27 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.546 2.338 . . . . 0.0 106.855 -169.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -136.43 173.67 11.46 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.99 1.316 . . . . 0.0 109.343 -173.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 67.3 mtp85 -59.04 154.71 37.73 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 118.702 -0.666 . . . . 0.0 109.608 172.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.13 -39.59 84.08 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.204 1.936 . . . . 0.0 109.517 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -64.12 -12.92 44.12 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.558 1.543 . . . . 0.0 113.196 -177.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 73.6 m -77.17 -3.24 38.5 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.079 0.854 . . . . 0.0 111.784 177.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.85 19.6 1.98 Allowed Glycine 0 C--N 1.336 0.568 0 CA-C-O 118.245 -1.308 . . . . 0.0 112.689 173.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.75 145.32 56.13 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 119.502 1.651 . . . . 0.0 108.984 169.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -130.34 -30.57 1.92 Allowed 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 124.0 0.92 . . . . 0.0 111.047 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 mttt -148.04 155.6 41.68 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.939 1.296 . . . . 0.0 107.93 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 89.8 m -87.37 130.65 34.56 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 122.957 0.503 . . . . 0.0 111.592 -176.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -177.04 -177.98 46.4 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 125.173 1.368 . . . . 0.0 110.82 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.408 ' HG2' ' HA ' ' A' ' 103' ' ' LEU . 13.3 mtm -149.99 171.83 16.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 127.195 2.198 . . . . 0.0 109.731 -176.348 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.2 m -151.09 167.95 26.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.705 1.202 . . . . 0.0 109.273 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.7 tp -144.94 98.87 3.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 126.445 1.898 . . . . 0.0 108.468 -169.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 28.1 m -103.97 143.47 32.83 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.408 1.083 . . . . 0.0 108.69 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.4 tt -133.84 134.29 42.61 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 171.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -103.24 133.82 47.69 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.045 0.938 . . . . 0.0 108.653 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -67.62 -29.61 68.98 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 168.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -130.71 82.53 2.06 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 127.099 2.16 . . . . 0.0 106.796 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -46.98 157.61 0.53 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 113.083 -1.871 . . . . 0.0 113.743 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 95.5 t -123.8 150.68 28.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 -174.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -112.19 98.46 7.33 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.107 0.963 . . . . 0.0 110.663 -168.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 . . . . . 0 CA--C 1.538 0.492 0 C-N-CA 124.322 1.049 . . . . 0.0 110.827 169.928 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo . . . . . 0 CA--C 1.534 0.521 0 CA-C-O 120.863 0.276 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 25.5 mm -92.46 131.38 39.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 173.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -101.06 -19.31 15.86 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 116.351 -1.785 . . . . 0.0 110.923 169.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.7 mt -130.48 134.35 47.01 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 121.513 1.961 . . . . 0.0 111.887 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.7 mp -139.86 109.78 6.41 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -174.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.8 mp -92.34 119.23 39.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 175.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.36 153.03 34.9 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 170.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.547 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -151.38 143.55 24.01 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 170.567 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.547 ' N ' HD23 ' A' ' 103' ' ' LEU . 79.4 p -142.73 146.31 34.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 168.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.625 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -144.91 145.94 31.79 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 118.915 0.78 . . . . 0.0 109.716 170.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.69 -13.11 59.71 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.538 -0.465 . . . . 0.0 111.351 -176.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -137.04 151.26 48.72 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.63 0.772 . . . . 0.0 110.024 175.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.51 77.54 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -177.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -72.34 -30.03 64.37 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.119 -0.988 . . . . 0.0 110.946 176.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.442 ' HB2' ' HB1' ' A' ' 105' ' ' ALA . 20.0 m -66.94 -35.55 80.24 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.79 -0.569 . . . . 0.0 110.444 169.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.625 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 28.5 m-70 -62.19 -45.0 95.34 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.343 0.974 . . . . 0.0 109.85 170.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.1 mm -56.32 -52.03 56.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 118.946 0.794 . . . . 0.0 109.267 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.37 -39.69 95.08 Favored Glycine 0 CA--C 1.529 0.939 0 CA-C-N 118.945 0.793 . . . . 0.0 111.81 -177.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.86 67.46 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.411 0.684 . . . . 0.0 110.874 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.6 mm -58.04 -46.23 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 C-N-CA 124.607 1.163 . . . . 0.0 108.167 176.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -68.21 -12.04 60.29 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.139 -0.975 . . . . 0.0 111.527 -177.168 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.57 -48.58 6.54 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 124.276 1.031 . . . . 0.0 109.546 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.45 HD11 ' CE ' ' A' ' 65' ' ' MET . 4.2 pp -68.83 -28.3 66.61 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.643 -177.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.7 m -61.7 -20.21 63.22 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 118.822 -0.609 . . . . 0.0 112.393 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -67.19 -14.49 62.95 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.611 1.096 . . . . 0.0 110.734 171.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 32.6 mt -111.68 -59.51 1.97 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.683 1.593 . . . . 0.0 110.734 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.1 -37.25 74.16 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.669 1.188 . . . . 0.0 113.125 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 42.3 m -100.7 25.46 7.84 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.557 0.343 . . . . 0.0 110.679 -172.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -133.95 99.08 4.33 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 124.676 1.191 . . . . 0.0 108.121 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -57.04 -27.28 61.53 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.476 0.71 . . . . 0.0 112.309 -178.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -64.0 -43.14 96.56 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.277 0.631 . . . . 0.0 110.065 175.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.3 mp -70.6 -42.83 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.2 mt -53.6 -40.43 65.68 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 119.247 0.93 . . . . 0.0 112.262 -175.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -71.56 -33.99 69.59 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 118.847 0.748 . . . . 0.0 110.569 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -72.31 -33.74 67.6 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 121.418 -0.801 . . . . 0.0 109.733 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -66.19 -53.92 31.5 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 26.8 mt -55.78 -30.22 60.95 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.136 0.574 . . . . 0.0 112.54 -174.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 32.1 p -91.56 2.86 56.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.273 1.029 . . . . 0.0 112.131 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.81 104.26 0.81 Allowed 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.465 1.106 . . . . 0.0 110.564 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 11.7 m -69.05 -26.61 65.05 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.37 0.668 . . . . 0.0 111.78 175.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.9 m -148.17 159.28 44.11 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.271 1.428 . . . . 0.0 108.954 -172.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -54.43 -31.66 55.8 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.36 1.464 . . . . 0.0 112.021 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -56.05 -34.46 65.92 Favored 'General case' 0 C--O 1.227 -0.083 0 C-N-CA 123.298 0.639 . . . . 0.0 112.616 -177.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -80.98 -26.47 36.51 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 119.451 1.023 . . . . 0.0 110.547 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 82.1 mt -71.07 -48.86 50.18 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 173.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -54.85 -38.55 67.6 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.893 1.277 . . . . 0.0 112.711 171.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -59.16 -47.73 84.24 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 118.941 0.791 . . . . 0.0 110.196 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 67.2 mt -65.91 -37.01 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 123.537 0.735 . . . . 0.0 110.292 -178.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 20.9 mm -57.32 -53.55 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 169.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 83.8 p -64.01 -29.5 70.65 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.129 0.49 . . . . 0.0 111.989 -169.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -57.93 -26.39 62.16 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.331 1.852 . . . . 0.0 113.342 176.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.876 0 N-CA-C 108.538 -1.825 . . . . 0.0 108.538 -177.684 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.3 tpt . . . . . 0 N--CA 1.488 1.433 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -67.15 114.56 6.0 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 169.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.32 -38.58 68.88 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 125.037 1.335 . . . . 0.0 110.038 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.86 -20.94 9.83 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.442 1.497 . . . . 0.0 112.891 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.84 -31.92 71.25 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 119.088 0.858 . . . . 0.0 112.508 175.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -87.08 -27.14 23.32 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 118.486 -0.768 . . . . 0.0 112.765 -171.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -91.42 104.31 9.66 Favored Pre-proline 0 CA--C 1.542 0.651 0 N-CA-C 103.801 -2.666 . . . . 0.0 103.801 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -63.46 -68.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.099 1.866 . . . . 0.0 113.686 -168.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -164.09 161.16 22.27 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.358 1.863 . . . . 0.0 106.38 171.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.0 m 53.07 22.87 2.7 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.34 1.056 . . . . 0.0 112.949 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.4 m -114.56 24.05 12.19 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 125.406 1.482 . . . . 0.0 110.691 -169.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.8 mt -131.52 129.69 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 103.863 -2.643 . . . . 0.0 103.863 178.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 m -150.38 149.24 29.8 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.475 0.71 . . . . 0.0 111.109 -173.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.7 t -123.65 142.61 39.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 169.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.6 mt -142.27 148.91 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 126.316 1.846 . . . . 0.0 106.168 -169.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -73.6 -46.58 46.23 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.553 -0.717 . . . . 0.0 109.911 172.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 p -163.21 144.47 9.57 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.54 158.61 33.44 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 169.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -58.18 -42.01 85.13 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.894 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -167.26 -177.43 3.66 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 127.931 2.492 . . . . 0.0 107.546 172.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -63.26 -33.18 74.95 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.493 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.6 mt-30 -60.29 -49.75 76.38 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 120.558 1.526 . . . . 0.0 107.433 173.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -61.88 -34.06 75.34 Favored 'General case' 0 C--O 1.221 -0.396 0 O-C-N 121.588 -0.695 . . . . 0.0 111.378 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.23 -32.01 71.91 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.658 -0.651 . . . . 0.0 111.262 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -46.4 82.84 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 171.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -56.51 -44.88 81.16 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.724 -0.61 . . . . 0.0 110.096 176.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -68.63 -13.92 62.68 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.216 -0.928 . . . . 0.0 113.083 174.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.5 m -82.96 -17.54 43.15 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.664 1.574 . . . . 0.0 111.592 169.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 3.3 mmt -130.35 -16.65 3.48 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -168.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.6 p -56.28 -37.02 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 120.173 1.351 . . . . 0.0 113.07 -169.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.2 m -68.33 -29.8 68.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.049 0.84 . . . . 0.0 111.645 -178.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 mt -75.91 -41.14 52.76 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 172.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.3 tp -58.46 -45.72 88.01 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.389 0.676 . . . . 0.0 110.568 179.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -60.15 -35.5 75.45 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.523 1.129 . . . . 0.0 112.118 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -96.54 17.25 16.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.738 -177.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.287 3.5 p30 43.06 38.17 1.39 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.941 1.696 . . . . 0.0 113.502 -176.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.438 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 24.3 m-85 -73.21 -18.05 61.29 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 168.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.9 pt -145.98 166.95 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 127.113 2.165 . . . . 0.0 108.522 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 p -94.84 165.03 12.67 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.52 1.128 . . . . 0.0 109.24 169.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.99 -35.64 75.45 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.279 -0.888 . . . . 0.0 111.066 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.06 -21.33 66.37 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.205 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -62.0 -42.72 99.46 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.526 1.057 . . . . 0.0 110.0 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -58.86 -50.3 79.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 123.45 0.7 . . . . 0.0 109.207 175.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -70.36 -24.76 63.02 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.924 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.42 -42.86 92.83 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.406 1.003 . . . . 0.0 110.252 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 74.5 mt -66.95 -47.15 83.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.493 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 93.2 mttt -60.72 -37.78 82.88 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.012 -177.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.53 -46.94 88.32 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 119.003 0.82 . . . . 0.0 111.301 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 46.2 m -68.48 -29.85 68.56 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.578 -0.701 . . . . 0.0 111.405 174.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 37.8 m . . . . . 0 CA--C 1.54 0.57 0 CA-C-N 118.279 0.491 . . . . 0.0 110.172 174.828 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 . . . . . 0 C--O 1.231 0.129 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.1 mm -140.4 138.48 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 177.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -123.27 -32.24 3.45 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.294 0.638 . . . . 0.0 111.692 -169.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.03 158.97 24.73 Favored Pre-proline 0 C--O 1.237 0.433 0 C-N-CA 126.927 2.091 . . . . 0.0 105.627 -175.17 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -60.0 117.04 3.74 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 121.505 1.47 . . . . 0.0 109.541 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 94.48 6.33 61.19 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.349 -1.25 . . . . 0.0 113.641 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.0 t -130.62 122.5 52.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 119.477 1.639 . . . . 0.0 108.197 -171.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.9 167.52 14.55 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.575 1.55 . . . . 0.0 109.461 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.425 ' CE ' HD13 ' A' ' 118' ' ' LEU . 12.8 ttm -143.38 66.81 16.23 Favored Pre-proline 0 C--N 1.331 -0.219 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 175.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -58.69 147.51 87.28 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 CA-C-O 122.472 0.947 . . . . 0.0 111.511 -173.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -179.54 155.02 0.65 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 128.365 2.666 . . . . 0.0 105.444 -169.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -133.9 153.74 51.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 169.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -54.45 145.14 39.49 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-O 117.685 -1.15 . . . . 0.0 109.377 -177.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -44.46 -44.91 13.21 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 123.818 3.012 . . . . 0.0 113.204 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.0 -14.51 48.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.617 1.567 . . . . 0.0 113.151 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 65.3 m -73.64 -25.24 60.19 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 118.613 0.642 . . . . 0.0 110.771 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 150.97 17.35 0.07 OUTLIER Glycine 0 C--N 1.337 0.609 0 CA-C-O 118.295 -1.28 . . . . 0.0 114.154 -178.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.22 152.54 44.94 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.142 1.471 . . . . 0.0 109.372 169.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.2 mt -131.65 -31.86 1.53 Allowed 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 124.128 0.971 . . . . 0.0 110.724 -175.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.438 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 75.3 mttt -146.68 158.24 43.87 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 125.628 1.571 . . . . 0.0 108.496 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.3 m -92.15 122.84 35.03 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.086 0.554 . . . . 0.0 110.184 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.07 -176.15 38.92 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.697 1.141 . . . . 0.0 111.02 -177.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 51.7 mtt -145.85 172.31 13.52 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.397 1.479 . . . . 0.0 110.64 -176.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 70.2 m -149.5 160.41 43.49 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.802 1.241 . . . . 0.0 109.06 169.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.4 tp -136.47 121.27 18.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.177 1.791 . . . . 0.0 108.892 -172.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.478 ' O ' HD22 ' A' ' 99' ' ' LEU . 91.5 m -137.63 129.76 29.09 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -171.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.2 tp -122.89 139.1 54.4 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.8 mp -119.84 118.81 31.77 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 126.559 1.944 . . . . 0.0 106.433 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -60.12 -24.5 64.73 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.769 0.827 . . . . 0.0 113.007 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -115.58 -9.28 12.04 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.63 1.172 . . . . 0.0 111.946 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 61.17 -176.98 4.51 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 123.734 0.683 . . . . 0.0 112.119 -169.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -149.6 160.62 5.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 169.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -105.32 108.33 19.78 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.519 0.676 . . . . 0.0 110.96 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 . . . . . 0 N--CA 1.448 -0.532 0 C-N-CA 124.572 1.149 . . . . 0.0 108.396 170.133 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo . . . . . 0 N--CA 1.456 -0.681 0 N-CA-C 111.031 -0.411 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 22.1 mm -87.13 131.9 33.87 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt -103.88 -25.76 12.93 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.97 169.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.478 HD22 ' O ' ' A' ' 82' ' ' THR . 3.0 tm? -134.06 132.27 39.81 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 120.655 1.57 . . . . 0.0 109.966 -174.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -131.24 126.76 36.33 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -174.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.0 mt -109.84 103.59 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 169.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -66.6 146.8 49.05 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 169.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.457 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -143.0 138.07 29.76 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 104.907 -2.257 . . . . 0.0 104.907 169.568 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.457 ' N ' HD23 ' A' ' 103' ' ' LEU . 94.9 p -131.34 147.95 52.62 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 126.139 1.775 . . . . 0.0 106.762 168.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -147.33 135.35 21.37 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.26 -21.52 58.5 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.753 0.421 . . . . 0.0 111.81 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -144.66 155.8 43.78 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.02 0.928 . . . . 0.0 109.825 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.18 -35.42 75.34 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.0 -31.05 62.78 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 120.894 -1.128 . . . . 0.0 111.064 176.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.8 m -64.8 -38.34 90.64 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.926 -0.484 . . . . 0.0 110.33 170.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -59.31 -49.72 76.76 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 123.521 0.729 . . . . 0.0 109.662 171.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.2 mm -55.37 -52.61 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.03 -39.72 96.07 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-N 119.098 0.863 . . . . 0.0 112.093 -177.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.85 -52.82 32.36 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.291 1.036 . . . . 0.0 110.635 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.9 mm -51.8 -47.86 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 C-N-CA 125.414 1.485 . . . . 0.0 108.571 174.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -67.45 -9.96 46.94 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 120.931 -1.106 . . . . 0.0 112.31 -177.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -91.46 -49.95 6.05 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 169.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.534 HD12 ' N ' ' A' ' 119' ' ' SER . 1.0 OUTLIER -70.77 -22.84 62.34 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -173.456 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 119' ' ' SER . . . . . 0.534 ' N ' HD12 ' A' ' 118' ' ' LEU . 33.7 m -62.95 -25.68 68.47 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.673 0.789 . . . . 0.0 111.135 172.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -66.75 -22.89 66.04 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.582 -0.699 . . . . 0.0 109.427 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 32.1 mt -95.04 -71.92 0.65 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.208 1.003 . . . . 0.0 110.621 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 22.5 mt -68.57 -16.47 63.87 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -169.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 32.1 m -97.28 27.75 4.02 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 120.176 1.353 . . . . 0.0 111.423 177.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -132.4 112.86 12.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.209 1.804 . . . . 0.0 106.388 173.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -61.89 -26.21 68.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.981 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -64.15 -42.87 96.59 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.006 0.523 . . . . 0.0 109.99 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.93 -43.21 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 123.689 0.796 . . . . 0.0 109.146 175.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 46.4 mt -55.02 -42.27 72.39 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 118.934 0.788 . . . . 0.0 111.095 -176.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -69.12 -36.5 77.56 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 118.579 -0.724 . . . . 0.0 111.015 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -65.21 -40.25 93.89 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 119.627 1.103 . . . . 0.0 108.951 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 24.6 mt -66.95 -52.6 40.97 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 176.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 54.9 mt -63.61 -9.0 11.42 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 61.1 p -122.7 10.48 9.66 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.688 1.195 . . . . 0.0 111.356 176.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.93 113.22 2.67 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 124.289 1.036 . . . . 0.0 109.72 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.5 m -74.63 -15.38 60.82 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.864 0.866 . . . . 0.0 112.212 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 85.8 p -153.05 163.09 40.48 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.894 0.854 . . . . 0.0 111.599 -173.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -58.04 -37.61 74.72 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.883 1.273 . . . . 0.0 109.494 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -60.67 -41.41 95.02 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 123.102 0.561 . . . . 0.0 110.945 175.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -65.38 -36.32 83.64 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 118.752 0.706 . . . . 0.0 112.138 176.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 36.4 mt -65.28 -46.93 78.47 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.641 1.11 . . . . 0.0 108.69 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.66 -32.97 67.83 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.921 0.888 . . . . 0.0 113.203 172.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -67.58 -40.52 84.84 Favored 'General case' 0 C--N 1.33 -0.243 0 O-C-N 121.103 -0.998 . . . . 0.0 110.412 177.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 71.1 mt -66.52 -36.76 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 123.777 0.831 . . . . 0.0 109.427 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.0 mm -58.61 -52.11 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 169.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 22.7 m -63.88 -27.78 69.39 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.259 0.224 . . . . 0.0 111.415 -173.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -60.09 -26.31 66.09 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.399 1.48 . . . . 0.0 113.104 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.867 0 N-CA-C 108.662 -1.775 . . . . 0.0 108.662 -178.643 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 tpp . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.4 mmm-85 -65.53 117.23 7.71 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 169.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.27 -44.92 94.91 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 177.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.3 p -56.36 -19.75 16.09 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.295 1.038 . . . . 0.0 113.187 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.25 -26.6 68.86 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.738 1.153 . . . . 0.0 112.338 174.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -96.87 -23.41 16.37 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 118.241 -0.885 . . . . 0.0 112.852 -172.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -101.81 101.55 18.76 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 120.298 1.408 . . . . 0.0 107.331 -173.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.55 -64.44 0.08 OUTLIER 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.378 2.719 . . . . 0.0 115.164 -169.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.439 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.9 tp10 -158.94 -77.68 0.07 Allowed 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.74 0.816 . . . . 0.0 111.908 -172.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.23 10.86 0.27 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.089 1.355 . . . . 0.0 111.502 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.439 ' H ' ' C ' ' A' ' 9' ' ' GLU . 1.8 p -79.27 12.09 2.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.149 2.18 . . . . 0.0 113.329 -169.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 mp -135.24 130.11 50.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 173.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.6 m -144.35 153.76 42.31 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.034 0.534 . . . . 0.0 110.866 175.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 74.1 t -122.81 142.23 40.14 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 106.182 -1.784 . . . . 0.0 106.182 170.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.4 mt -140.59 146.11 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 -170.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 48.8 m-70 -65.42 -51.94 56.8 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 174.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -159.0 147.63 18.3 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.497 ' HB3' HG21 ' A' ' 88' ' ' VAL . . . -76.06 149.84 37.42 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 171.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 tmmm? -58.2 -39.22 78.39 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.029 0.532 . . . . 0.0 109.788 177.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -161.67 175.93 11.5 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 126.465 1.906 . . . . 0.0 107.937 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -69.16 -33.69 73.8 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 123.364 0.665 . . . . 0.0 111.552 174.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.405 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 4.8 pt20 -61.18 -41.82 97.48 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 119.858 1.208 . . . . 0.0 108.884 169.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -67.44 -32.89 74.06 Favored 'General case' 0 C--O 1.223 -0.319 0 O-C-N 121.606 -0.684 . . . . 0.0 111.561 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -34.83 78.94 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.946 0.498 . . . . 0.0 110.005 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.34 -46.79 80.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 169.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -55.12 -47.23 75.33 Favored 'General case' 0 C--O 1.226 -0.171 0 C-N-CA 122.954 0.501 . . . . 0.0 110.047 -176.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -66.28 -31.37 72.13 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.441 174.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.8 m -61.87 -22.49 65.58 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.918 1.235 . . . . 0.0 112.032 172.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.2 mmt -123.06 -17.51 6.67 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -169.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.34 -36.51 52.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 120.619 1.554 . . . . 0.0 113.019 -169.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.6 m -67.31 -31.76 72.27 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.989 0.813 . . . . 0.0 110.932 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 73.3 mt -73.49 -40.95 63.7 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.748 0.819 . . . . 0.0 109.106 173.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.0 tp -59.34 -44.61 92.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.455 0.702 . . . . 0.0 110.495 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -64.25 -42.51 96.48 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 124.222 1.009 . . . . 0.0 111.693 -176.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.3 13.7 3.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.98 1.312 . . . . 0.0 111.735 175.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.301 6.2 p30 44.51 37.47 2.13 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.68 1.992 . . . . 0.0 114.944 -176.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -69.9 -18.94 63.42 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.088 -1.008 . . . . 0.0 109.492 168.289 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.7 pt -145.86 168.33 7.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 126.736 2.014 . . . . 0.0 108.766 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 m -106.13 162.02 14.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.775 1.63 . . . . 0.0 108.695 169.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -58.78 -36.88 75.15 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.172 -0.955 . . . . 0.0 112.28 -174.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -59.99 -24.08 64.16 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.893 0.877 . . . . 0.0 113.007 175.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -63.74 -46.16 86.59 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 119.485 1.039 . . . . 0.0 110.264 175.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.5 -47.92 90.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -66.94 -27.66 67.65 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 118.473 -0.775 . . . . 0.0 111.774 -175.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.35 74.33 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.323 0.965 . . . . 0.0 111.691 173.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 26.1 mt -76.12 -50.59 22.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 82.3 mttt -57.89 -44.68 86.86 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 -173.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.9 -50.69 71.2 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.377 0.671 . . . . 0.0 111.071 -172.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.5 m -66.2 -38.74 88.72 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 118.051 0.387 . . . . 0.0 110.744 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.1 m . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 123.137 0.575 . . . . 0.0 111.012 174.479 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 . . . . . 0 N--CA 1.457 -0.106 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.5 mm -124.29 136.64 59.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -122.25 -30.38 4.01 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.304 0.642 . . . . 0.0 111.666 -169.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.59 160.91 27.73 Favored Pre-proline 0 C--O 1.236 0.351 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -57.08 113.51 1.51 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 121.857 1.704 . . . . 0.0 108.959 169.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.22 -8.94 49.52 Favored Glycine 0 CA--C 1.531 1.088 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.187 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.2 t -129.48 125.1 61.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 CA-C-N 119.943 1.871 . . . . 0.0 109.831 -169.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -123.68 167.99 13.25 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 125.687 1.595 . . . . 0.0 109.684 175.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 ttm -141.86 62.27 14.22 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -49.58 142.3 24.41 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.417 2.078 . . . . 0.0 114.421 -175.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 179.93 153.7 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 128.754 2.822 . . . . 0.0 106.256 -171.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.92 159.26 42.01 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 125.741 1.616 . . . . 0.0 107.609 169.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 32.1 mtp-105 -51.16 142.66 18.37 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-O 117.707 -1.139 . . . . 0.0 109.203 177.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_exo -45.53 -42.02 18.38 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.716 2.944 . . . . 0.0 113.091 -178.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -61.31 -14.48 27.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.429 1.492 . . . . 0.0 113.336 -177.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.9 m -77.76 -9.27 58.92 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.588 0.755 . . . . 0.0 112.011 -178.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 137.12 17.28 0.71 Allowed Glycine 0 CA--C 1.527 0.82 0 CA-C-O 118.195 -1.336 . . . . 0.0 113.868 178.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.97 149.38 47.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.801 1.8 . . . . 0.0 109.463 169.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.2 mt -129.43 -35.86 1.72 Allowed 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.781 1.233 . . . . 0.0 110.146 -176.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -144.76 158.93 43.6 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.502 1.521 . . . . 0.0 108.49 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 76.1 m -90.97 127.25 36.34 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.147 0.579 . . . . 0.0 110.367 -178.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -170.98 -178.69 41.7 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.978 1.275 . . . . 0.0 110.836 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 37.9 mtt -145.44 170.36 16.53 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.675 1.59 . . . . 0.0 110.713 -177.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.8 m -152.79 171.5 18.16 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.355 1.462 . . . . 0.0 109.245 169.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.9 tp -143.81 128.86 18.6 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 127.052 2.141 . . . . 0.0 107.895 -169.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 90.5 m -130.46 143.14 50.57 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.057 1.343 . . . . 0.0 107.554 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.2 tp -134.17 143.33 47.83 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 171.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -113.3 137.73 51.06 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.591 1.156 . . . . 0.0 108.724 176.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -69.36 -40.98 77.15 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 168.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -118.92 96.35 5.21 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.964 2.106 . . . . 0.0 107.996 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -50.85 156.96 2.51 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.002 1.286 . . . . 0.0 112.942 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.497 HG21 ' HB3' ' A' ' 18' ' ' ALA . 84.1 t -118.84 152.78 21.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -113.85 93.95 4.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.899 0.879 . . . . 0.0 110.458 -167.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 . . . . . 0 CA--C 1.538 0.508 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.078 169.838 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo . . . . . 0 CA--C 1.531 0.353 0 N-CA-C 113.391 0.497 . . . . 0.0 113.391 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 39.9 mm -111.42 132.83 58.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -105.44 -15.4 15.03 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 117.347 -1.311 . . . . 0.0 110.973 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 46.4 tp -140.21 131.08 25.99 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 120.279 1.4 . . . . 0.0 109.979 -169.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.8 mp -137.53 138.87 40.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -176.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 3.7 mt -118.03 119.88 62.81 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 169.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.21 148.47 32.88 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.964 -1.654 . . . . 0.0 108.964 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.413 HD12 HD21 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -143.13 136.79 28.59 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 104.402 -2.444 . . . . 0.0 104.402 169.445 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.0 p -129.95 147.48 51.71 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 106.43 -1.692 . . . . 0.0 106.43 169.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.3 136.35 23.56 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 118.911 0.778 . . . . 0.0 109.244 -176.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.19 -22.63 55.1 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.804 0.442 . . . . 0.0 111.87 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -145.66 155.86 43.28 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.826 0.85 . . . . 0.0 109.984 -178.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.18 -34.97 74.33 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -75.09 -31.92 61.33 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 120.84 -1.162 . . . . 0.0 111.01 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.5 m -63.55 -40.59 97.39 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 122.095 -0.378 . . . . 0.0 110.025 169.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -58.28 -48.75 79.49 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.753 0.821 . . . . 0.0 110.104 172.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 11.1 mm -56.21 -53.63 37.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 123.472 0.709 . . . . 0.0 109.345 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.9 -39.05 96.39 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 118.822 0.737 . . . . 0.0 111.691 -176.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.61 -52.51 44.45 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.343 1.057 . . . . 0.0 110.451 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.5 mm -53.05 -47.32 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 C-N-CA 125.322 1.449 . . . . 0.0 108.791 176.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -66.96 -16.29 64.25 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.735 -0.603 . . . . 0.0 111.858 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -87.48 -46.38 9.65 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.695 0.798 . . . . 0.0 109.534 174.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.413 HD21 HD12 ' A' ' 103' ' ' LEU . 3.9 pp -71.17 -23.95 62.15 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.171 -178.122 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 63.0 m -59.5 -23.4 62.75 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.4 0.68 . . . . 0.0 112.11 172.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -64.62 -20.92 66.56 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.164 0.893 . . . . 0.0 110.25 173.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 31.0 mt -106.59 -60.71 1.63 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.631 1.572 . . . . 0.0 111.095 -178.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.24 -31.55 69.18 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.916 1.286 . . . . 0.0 113.622 -177.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 60.5 m -101.67 26.97 6.78 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 118.681 0.673 . . . . 0.0 110.832 -175.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -139.94 93.21 2.62 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -170.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.1 -27.0 41.83 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.949 0.9 . . . . 0.0 112.756 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.95 -45.55 91.95 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 122.882 0.473 . . . . 0.0 110.034 176.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.5 mp -68.16 -45.34 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.907 0.883 . . . . 0.0 108.817 175.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 73.0 mt -54.78 -42.69 72.06 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 118.753 -0.642 . . . . 0.0 111.291 -174.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -67.05 -40.87 87.19 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 118.407 0.549 . . . . 0.0 110.601 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.19 -33.99 74.23 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 118.71 0.687 . . . . 0.0 110.124 -176.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 23.4 mt -69.74 -53.37 18.72 Favored 'General case' 0 C--O 1.224 -0.239 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 170.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 31.4 mt -57.41 -21.05 33.92 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -176.111 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 82.6 p -114.21 8.53 16.88 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.539 1.136 . . . . 0.0 111.181 -177.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.92 125.32 22.56 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.206 1.002 . . . . 0.0 110.244 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.9 m -85.27 -10.1 56.9 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.119 0.968 . . . . 0.0 111.683 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 71.9 p -154.4 159.19 40.97 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.903 0.774 . . . . 0.0 110.451 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -59.16 -33.51 71.01 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.175 0.59 . . . . 0.0 109.644 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -57.75 -39.27 76.96 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 118.967 -0.539 . . . . 0.0 111.236 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -66.32 -44.4 83.48 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.806 0.73 . . . . 0.0 111.671 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.02 -50.28 71.3 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.769 0.713 . . . . 0.0 109.135 178.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.01 -32.6 66.31 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.912 1.285 . . . . 0.0 113.381 173.289 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.12 -43.26 82.87 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 119.877 1.217 . . . . 0.0 110.054 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 88.9 mt -64.91 -36.43 77.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 123.732 0.813 . . . . 0.0 109.587 178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 29.8 mm -58.51 -52.28 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 33.8 m -66.77 -26.41 66.95 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.754 0.422 . . . . 0.0 111.385 -171.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -57.69 -28.85 64.18 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.868 1.667 . . . . 0.0 113.001 173.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.933 0 N-CA-C 109.002 -1.639 . . . . 0.0 109.002 -174.765 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 tpt . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -66.79 109.21 2.8 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 169.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -52.24 -42.08 63.32 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.211 0.604 . . . . 0.0 110.05 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.61 -22.47 13.55 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.853 1.661 . . . . 0.0 113.485 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -65.71 -26.85 67.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.153 0.888 . . . . 0.0 112.094 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -96.71 -19.08 19.23 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.189 -170.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -97.7 112.72 62.22 Favored Pre-proline 0 CA--C 1.546 0.809 0 CA-C-N 120.864 1.665 . . . . 0.0 108.75 -173.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.69 -173.22 0.09 OUTLIER 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 125.236 3.957 . . . . 0.0 114.711 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -72.99 145.61 46.58 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 171.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.1 m 50.08 24.36 1.38 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.359 1.464 . . . . 0.0 112.428 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 p -74.49 -9.04 58.2 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.444 -0.785 . . . . 0.0 112.357 -172.44 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.4 mp -115.49 136.94 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 C-N-CA 126.634 1.973 . . . . 0.0 107.048 -170.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.7 m -144.76 156.22 43.94 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.714 1.206 . . . . 0.0 110.335 -177.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.6 t -129.66 144.55 37.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 174.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mt -143.29 150.09 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 126.294 1.838 . . . . 0.0 106.539 -170.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -74.93 -48.2 25.8 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.565 -0.709 . . . . 0.0 109.883 171.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -159.95 144.19 14.6 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.184 -1.413 . . . . 0.0 107.184 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.17 162.12 24.87 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 169.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.3 tppt? -59.37 -43.75 92.83 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.033 0.533 . . . . 0.0 110.554 178.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -167.17 -178.1 3.98 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 127.679 2.392 . . . . 0.0 107.758 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.5 p-90 -64.3 -32.7 74.41 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.498 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.4 mt-30 -59.31 -52.7 64.52 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.706 1.594 . . . . 0.0 107.381 172.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -60.05 -36.55 77.56 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 121.803 -0.56 . . . . 0.0 111.295 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.61 -30.14 71.16 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 118.833 -0.603 . . . . 0.0 111.09 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -69.09 -47.7 73.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 119.292 0.951 . . . . 0.0 108.548 172.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -55.68 -47.74 76.26 Favored 'General case' 0 C--O 1.227 -0.098 0 CA-C-N 118.315 0.507 . . . . 0.0 109.883 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -61.41 -33.59 73.96 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 117.928 -1.034 . . . . 0.0 111.974 174.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.1 m -64.83 -29.97 70.95 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 119.987 1.267 . . . . 0.0 112.428 175.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.6 mmm -115.95 -13.98 11.27 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -168.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -58.58 -33.85 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 120.299 1.409 . . . . 0.0 112.514 -169.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.7 p -65.78 -37.62 86.8 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.327 0.967 . . . . 0.0 110.652 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 77.7 mt -72.17 -37.81 69.26 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.587 0.755 . . . . 0.0 109.268 175.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.47 -44.23 96.1 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.685 0.675 . . . . 0.0 110.306 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -63.89 -45.09 90.91 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.878 1.271 . . . . 0.0 111.827 -176.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -80.44 12.52 2.96 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.282 1.033 . . . . 0.0 111.595 175.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.33 4.6 p30 43.54 43.21 4.46 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.821 2.049 . . . . 0.0 114.891 -176.263 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.412 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 35.9 m-85 -75.96 -17.15 59.84 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 167.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.5 pt -145.26 173.82 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.653 1.981 . . . . 0.0 109.271 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.6 m -114.66 163.03 16.0 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.164 1.786 . . . . 0.0 109.267 169.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.21 -32.82 72.59 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.308 -0.87 . . . . 0.0 113.047 -170.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -58.23 -30.89 66.87 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.83 -0.544 . . . . 0.0 111.729 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -59.06 -46.59 87.86 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.391 0.676 . . . . 0.0 110.38 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.8 mp -56.73 -48.37 81.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 123.612 0.765 . . . . 0.0 109.001 176.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -69.29 -26.24 64.64 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.264 -0.874 . . . . 0.0 112.027 -176.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.2 -39.37 93.84 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.828 1.195 . . . . 0.0 111.508 173.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 53.3 mt -66.5 -46.42 86.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.498 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.5 mttt -62.09 -42.4 99.18 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -178.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.18 -38.61 91.68 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 124.009 0.924 . . . . 0.0 111.407 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 m -62.93 -40.54 97.92 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.815 -0.553 . . . . 0.0 110.187 172.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 26.1 m . . . . . 0 CA--C 1.542 0.636 0 C-N-CA 123.762 0.825 . . . . 0.0 111.17 174.444 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 . . . . . 0 N--CA 1.454 -0.229 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.4 mm -135.67 131.96 50.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 -173.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -124.55 -24.41 4.21 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 123.805 0.691 . . . . 0.0 110.918 -172.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.53 165.28 19.07 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 124.689 1.196 . . . . 0.0 108.112 170.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -49.35 126.94 16.79 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.338 2.025 . . . . 0.0 110.062 169.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.39 1.82 77.19 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-O 117.88 -1.511 . . . . 0.0 115.48 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 77.8 t -131.01 117.31 37.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-N 120.322 2.061 . . . . 0.0 108.355 -173.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.17 163.57 16.87 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.687 1.595 . . . . 0.0 109.917 -177.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.7 ttm -134.14 60.68 46.1 Favored Pre-proline 0 CA--C 1.545 0.751 0 CA-C-O 118.998 -0.525 . . . . 0.0 112.096 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -54.06 147.82 42.03 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.345 2.03 . . . . 0.0 113.293 -172.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 175.6 157.52 0.21 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 128.726 2.811 . . . . 0.0 106.542 -168.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.39 159.12 42.85 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 126.137 1.775 . . . . 0.0 107.931 169.399 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -51.21 143.34 17.52 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-O 118.3 -0.857 . . . . 0.0 109.322 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -47.91 -42.07 31.81 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.079 2.519 . . . . 0.0 113.017 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -62.22 -13.34 26.9 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.873 1.269 . . . . 0.0 114.05 -177.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 72.2 m -77.39 -6.12 52.21 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.636 0.774 . . . . 0.0 111.897 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 132.91 18.03 1.12 Allowed Glycine 0 CA--C 1.524 0.655 0 CA-C-O 118.206 -1.33 . . . . 0.0 113.315 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.45 148.13 49.99 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.792 1.796 . . . . 0.0 108.986 169.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.6 mt -127.66 -35.19 2.14 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 124.827 1.251 . . . . 0.0 110.501 -175.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.412 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 52.8 mttp -142.4 158.83 43.28 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 125.707 1.603 . . . . 0.0 107.916 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.1 m -91.15 125.17 35.85 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 123.157 0.583 . . . . 0.0 109.709 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -171.94 179.79 43.38 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.672 1.13 . . . . 0.0 110.966 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.627 ' SD ' HD21 ' A' ' 118' ' ' LEU . 56.7 mtt -143.23 167.95 20.92 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 125.453 1.501 . . . . 0.0 110.154 -172.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.4 p -148.57 167.53 25.16 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.926 1.291 . . . . 0.0 108.346 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.486 HD22 HD11 ' A' ' 144' ' ' ILE . 5.1 tp -142.75 124.71 15.22 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.609 -0.682 . . . . 0.0 109.77 -176.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 64.9 m -131.77 133.49 44.81 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.5 tp -126.44 139.11 53.5 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 173.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.3 mp -119.31 123.27 43.81 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 105.296 -2.112 . . . . 0.0 105.296 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.1 -41.26 92.18 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.666 0.667 . . . . 0.0 111.532 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 -90.69 -16.7 28.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.383 1.073 . . . . 0.0 111.724 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.21 178.86 9.1 Favored Glycine 0 CA--C 1.534 1.272 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -168.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.07 156.88 15.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 168.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -102.87 99.29 9.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.908 0.861 . . . . 0.0 112.189 -168.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 . . . . . 0 CA--C 1.539 0.525 0 CA-C-N 114.332 -1.304 . . . . 0.0 108.484 169.441 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo . . . . . 0 N--CA 1.459 -0.539 0 CA-C-O 120.788 0.245 . . . . 0.0 112.116 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 27.9 mm -69.47 111.41 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 175.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -82.94 -29.53 29.05 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 116.743 -1.599 . . . . 0.0 110.409 169.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.8 tp -132.68 139.94 47.9 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 121.174 1.806 . . . . 0.0 112.126 -173.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.0 mp -134.6 103.27 5.6 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -178.179 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.654 HG21 HD22 ' A' ' 118' ' ' LEU . 0.6 OUTLIER -83.17 118.1 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.142 0 N-CA-C 104.442 -2.429 . . . . 0.0 104.442 169.258 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.35 150.81 26.23 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 172.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.405 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -142.9 142.86 31.83 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 169.839 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.405 ' N ' HD23 ' A' ' 103' ' ' LEU . 16.3 m -142.85 143.52 32.13 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 169.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.46 139.08 29.7 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 -169.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.39 -23.26 43.39 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.153 0.581 . . . . 0.0 111.92 -176.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -145.48 156.63 43.85 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.172 0.989 . . . . 0.0 109.809 -178.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.77 -34.75 73.4 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.178 0.806 . . . . 0.0 113.178 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -75.78 -32.34 59.86 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 120.936 -1.103 . . . . 0.0 111.062 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.2 m -62.32 -42.01 99.01 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 169.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 35.5 t60 -57.92 -49.09 77.94 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.034 0.933 . . . . 0.0 110.211 173.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 8.9 mm -56.21 -54.77 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 118.869 0.759 . . . . 0.0 109.444 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.24 -38.48 94.61 Favored Glycine 0 CA--C 1.531 1.035 0 CA-C-N 118.664 0.666 . . . . 0.0 111.71 -176.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.78 -49.48 58.31 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.493 1.117 . . . . 0.0 110.816 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.9 mm -55.94 -43.05 73.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 124.448 1.099 . . . . 0.0 108.989 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.3 mm-40 -70.49 -12.88 61.86 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.461 0.704 . . . . 0.0 112.061 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.26 -43.67 14.62 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 170.079 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.654 HD22 HG21 ' A' ' 101' ' ' ILE . 96.3 mt -70.06 -27.71 64.86 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 121.864 -0.523 . . . . 0.0 111.759 -176.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 27.9 m -57.65 -21.87 42.39 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 171.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -74.89 -22.46 58.63 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.556 1.071 . . . . 0.0 111.058 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 49.2 mt -101.98 -62.22 1.29 Allowed 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 123.872 0.869 . . . . 0.0 110.639 -177.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.37 -13.24 58.16 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.402 1.481 . . . . 0.0 113.62 -173.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 37.3 m -117.81 29.86 7.59 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.039 0.836 . . . . 0.0 110.511 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -131.98 107.99 9.05 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 123.841 0.856 . . . . 0.0 109.035 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -55.96 -34.58 65.83 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.721 1.208 . . . . 0.0 110.454 -176.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -61.79 -44.84 96.08 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.242 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.35 -44.05 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 124.372 1.069 . . . . 0.0 109.351 177.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 7.0 mp -50.52 -45.24 56.56 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 119.123 0.874 . . . . 0.0 111.506 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -68.73 -37.09 79.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.829 0.74 . . . . 0.0 110.698 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -64.69 -40.49 95.48 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 118.969 0.804 . . . . 0.0 108.913 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.3 mt -69.12 -53.38 20.5 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.0 mt -61.44 -11.85 12.23 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.232 1.013 . . . . 0.0 113.575 -174.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 70.8 p -121.87 5.83 9.91 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.593 1.157 . . . . 0.0 111.661 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.63 119.58 7.86 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 124.58 1.152 . . . . 0.0 110.539 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -76.59 -15.6 59.8 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.186 0.994 . . . . 0.0 112.345 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.4 p -153.41 163.44 39.92 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 119.077 0.853 . . . . 0.0 111.502 -172.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 51.6 mp0 -59.09 -35.86 74.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.011 0.924 . . . . 0.0 109.18 169.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -59.15 -47.08 86.62 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 122.855 0.462 . . . . 0.0 110.96 175.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.57 -34.14 77.56 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.4 mt -66.34 -46.38 77.0 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.398 0.999 . . . . 0.0 109.276 174.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.11 -31.99 73.26 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.423 0.689 . . . . 0.0 112.445 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -58.59 -36.51 74.09 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.914 -1.116 . . . . 0.0 110.987 175.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 68.2 mt -71.74 -36.47 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 C-N-CA 124.083 0.953 . . . . 0.0 109.932 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ILE . . . . . 0.486 HD11 HD22 ' A' ' 81' ' ' LEU . 50.7 mm -52.88 -52.5 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.008 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 24.8 m -69.23 -29.15 67.03 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.215 -171.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.0 ttm105 -70.07 -37.11 75.39 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 125.375 1.47 . . . . 0.0 110.628 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.166 -1.352 . . . . 0.0 111.229 177.971 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpp? . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -68.06 112.38 5.0 Favored 'General case' 0 C--N 1.341 0.225 0 N-CA-C 104.281 -2.488 . . . . 0.0 104.281 168.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -53.41 -39.01 63.98 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.321 0.648 . . . . 0.0 110.368 -175.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.7 p -53.4 -19.74 3.82 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.972 1.709 . . . . 0.0 114.066 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -60.86 -23.45 65.15 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.924 1.238 . . . . 0.0 112.706 175.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.61 -14.71 15.53 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -170.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -102.27 109.58 60.63 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 120.465 1.484 . . . . 0.0 108.079 -173.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -62.05 -70.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.042 2.495 . . . . 0.0 113.664 -173.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -163.15 -71.9 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.936 0.894 . . . . 0.0 111.637 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 m -69.86 6.4 1.21 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.69 1.196 . . . . 0.0 111.912 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -6.12 37.55 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.856 1.662 . . . . 0.0 113.593 -169.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.8 mt -122.75 130.14 74.69 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.787 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 -169.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.9 p -155.71 151.06 26.9 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.642 0.734 . . . . 0.0 111.914 -176.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.9 t -121.14 141.29 42.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 170.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.6 mt -136.58 145.99 29.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 C-N-CA 125.142 1.377 . . . . 0.0 108.214 -169.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -71.36 -38.43 71.58 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.807 -0.558 . . . . 0.0 111.699 175.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.9 p -174.33 148.15 1.23 Allowed 'General case' 0 C--O 1.237 0.403 0 N-CA-C 105.393 -2.077 . . . . 0.0 105.393 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.12 150.45 35.61 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 170.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.71 -41.55 81.98 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 176.177 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -157.61 169.65 24.19 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 126.78 2.032 . . . . 0.0 106.667 171.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -34.7 59.91 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.322 1.449 . . . . 0.0 112.718 169.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.465 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 26.2 mt-30 -60.64 -48.44 81.76 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.68 1.127 . . . . 0.0 109.383 170.041 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -63.5 -32.29 73.7 Favored 'General case' 0 C--O 1.223 -0.34 0 O-C-N 121.771 -0.581 . . . . 0.0 111.263 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.1 -36.29 83.09 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 121.833 -0.542 . . . . 0.0 110.059 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.99 -46.63 78.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 172.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -54.87 -45.85 74.67 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 121.751 -0.593 . . . . 0.0 110.697 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -65.32 -31.83 73.16 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 118.299 -0.858 . . . . 0.0 112.034 174.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.2 m -65.21 -20.3 66.37 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.618 1.099 . . . . 0.0 112.348 172.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.6 mmt -125.91 -20.02 4.7 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 114.919 1.452 . . . . 0.0 114.919 -168.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -60.03 -37.07 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 CA-C-N 120.714 1.597 . . . . 0.0 111.727 -169.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.3 m -65.39 -19.28 65.88 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.694 -0.629 . . . . 0.0 112.283 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 90.5 mt -91.36 -41.57 10.83 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.761 1.225 . . . . 0.0 109.144 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.6 tp -54.93 -42.68 72.55 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.007 0.923 . . . . 0.0 110.491 176.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -66.27 -28.33 68.63 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 125.312 1.445 . . . . 0.0 113.108 -173.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -99.54 18.52 17.71 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 118.241 0.473 . . . . 0.0 110.611 174.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.304 6.3 p30 46.72 38.43 5.81 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.539 1.536 . . . . 0.0 114.395 -171.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -68.42 -22.59 64.6 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.822 -1.174 . . . . 0.0 109.557 168.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.6 pt -143.43 177.24 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 126.446 1.898 . . . . 0.0 109.047 -176.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.8 m -117.16 157.46 25.91 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.603 1.961 . . . . 0.0 108.062 175.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.35 -31.79 70.65 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.026 -1.047 . . . . 0.0 112.94 -172.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -58.21 -33.24 69.08 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.887 -0.508 . . . . 0.0 111.878 175.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -60.09 -44.47 94.78 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.459 0.704 . . . . 0.0 110.494 -176.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -58.2 -50.94 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 174.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.0 tp60 -68.89 -26.17 64.98 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.412 -0.804 . . . . 0.0 112.058 -174.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.55 -43.64 89.39 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.493 1.042 . . . . 0.0 110.508 173.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 43.1 mt -68.3 -49.22 68.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.4 mttt -57.86 -42.51 84.63 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -61.35 -51.36 69.14 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.69 0.796 . . . . 0.0 111.242 -173.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 41.4 m -64.98 -39.9 94.16 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 118.306 0.503 . . . . 0.0 110.552 176.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 88.3 m . . . . . 0 CA--C 1.537 0.456 0 C-N-CA 122.964 0.506 . . . . 0.0 111.388 176.411 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 . . . . . 0 N--CA 1.456 -0.148 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 39.3 mm -136.22 136.01 49.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 104.919 -2.252 . . . . 0.0 104.919 -174.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -122.89 -30.65 3.78 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 123.215 0.606 . . . . 0.0 110.893 -170.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.57 157.94 27.08 Favored Pre-proline 0 N--CA 1.452 -0.343 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 173.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -51.99 120.02 6.56 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.026 1.818 . . . . 0.0 109.139 169.527 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 102.81 -15.68 55.31 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-O 117.942 -1.477 . . . . 0.0 114.117 -178.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 98.0 t -129.11 119.52 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 119.769 1.785 . . . . 0.0 109.538 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -116.49 166.85 11.61 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.689 1.596 . . . . 0.0 109.385 173.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 13.5 ttm -137.37 60.68 28.11 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.667 175.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -49.7 137.13 34.36 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 122.277 1.985 . . . . 0.0 113.98 -172.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -177.63 153.12 0.85 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 128.45 2.7 . . . . 0.0 106.706 -169.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.35 161.07 36.01 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 126.392 1.877 . . . . 0.0 107.459 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -53.63 143.14 39.68 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-O 117.651 -1.166 . . . . 0.0 108.876 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -46.83 -41.28 25.22 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.643 2.895 . . . . 0.0 113.246 -177.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -58.68 -14.72 9.17 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.601 1.56 . . . . 0.0 114.134 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 61.8 m -77.9 -4.61 47.62 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.66 0.784 . . . . 0.0 111.663 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 131.48 14.36 1.75 Allowed Glycine 0 C--N 1.337 0.597 0 CA-C-O 118.039 -1.423 . . . . 0.0 113.244 172.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.18 145.01 56.29 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 119.693 1.747 . . . . 0.0 109.289 169.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.5 mt -128.48 -34.82 2.0 Allowed 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.937 1.295 . . . . 0.0 110.291 -173.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -142.47 163.85 31.71 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 126.111 1.764 . . . . 0.0 108.026 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.1 m -97.49 130.79 44.54 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.187 0.595 . . . . 0.0 110.507 -176.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -173.74 179.48 45.09 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.742 1.163 . . . . 0.0 111.211 -176.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.633 ' SD ' HD21 ' A' ' 118' ' ' LEU . 56.4 mtt -144.89 167.85 21.64 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.168 1.387 . . . . 0.0 112.059 -172.097 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.3 m -138.33 166.16 24.91 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.076 1.75 . . . . 0.0 108.918 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.55 HD22 HD11 ' A' ' 144' ' ' ILE . 49.8 tp -147.85 85.47 1.55 Allowed 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.767 1.627 . . . . 0.0 108.025 -171.567 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.1 m -104.62 135.11 46.64 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.429 HD13 HD13 ' A' ' 99' ' ' LEU . 14.1 tp -129.58 142.62 50.71 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 173.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.6 mp -122.4 132.72 54.5 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.784 1.634 . . . . 0.0 106.795 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.0 -48.14 72.17 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 123.135 0.574 . . . . 0.0 110.237 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -90.43 -13.76 34.25 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.742 0.817 . . . . 0.0 112.317 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 64.31 -176.44 10.18 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 110.691 -0.963 . . . . 0.0 110.691 -168.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -148.53 167.8 3.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 169.272 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -120.3 96.6 5.21 Favored 'General case' 0 C--N 1.334 -0.079 0 O-C-N 121.643 -0.661 . . . . 0.0 110.699 -169.149 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.626 169.744 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 N--CA 1.459 -0.509 0 CA-C-O 121.808 0.67 . . . . 0.0 112.25 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 36.3 mm -111.04 136.34 47.4 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -177.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -108.74 -14.42 14.6 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 117.118 -1.42 . . . . 0.0 110.988 173.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.429 HD13 HD13 ' A' ' 83' ' ' LEU . 14.1 tp -139.3 136.25 34.67 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 120.854 1.661 . . . . 0.0 110.787 -175.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.6 mp -139.1 95.5 2.95 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 -172.279 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.665 HG21 HD22 ' A' ' 118' ' ' LEU . 1.7 mp -76.69 118.7 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 106.326 -1.731 . . . . 0.0 106.326 169.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -77.95 150.11 35.41 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 170.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.432 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -146.41 139.03 25.28 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 169.0 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.432 ' N ' HD23 ' A' ' 103' ' ' LEU . 4.0 m -142.5 144.93 33.2 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 169.314 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.16 138.96 25.57 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -170.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -78.9 -23.28 44.88 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.818 0.447 . . . . 0.0 111.982 -175.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -143.68 155.51 44.25 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.838 0.855 . . . . 0.0 109.825 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.93 -35.66 73.47 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.648 0.779 . . . . 0.0 113.013 -177.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -76.14 -32.32 59.05 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.059 -1.026 . . . . 0.0 111.173 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.9 m -62.31 -41.57 98.63 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 169.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -57.88 -50.03 74.7 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.229 1.011 . . . . 0.0 110.056 172.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.0 mm -56.16 -54.34 28.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 118.709 0.686 . . . . 0.0 109.412 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.41 -39.4 96.18 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-N 118.775 0.716 . . . . 0.0 111.561 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.54 -49.62 62.45 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.183 0.993 . . . . 0.0 110.819 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.5 mm -55.63 -44.01 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.548 1.139 . . . . 0.0 108.974 176.648 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -70.72 -12.39 61.53 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.54 0.736 . . . . 0.0 112.032 -178.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.51 -45.21 13.83 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 170.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.665 HD22 HG21 ' A' ' 101' ' ' ILE . 94.7 mt -69.84 -28.64 65.85 Favored 'General case' 0 CA--C 1.515 -0.371 0 O-C-N 121.919 -0.488 . . . . 0.0 111.732 -176.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.0 m -60.91 -20.76 62.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.241 0.616 . . . . 0.0 112.33 171.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -71.6 -22.57 61.7 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.672 1.124 . . . . 0.0 110.4 174.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 45.4 mt -103.3 -64.67 1.06 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.157 0.983 . . . . 0.0 110.284 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.402 HD11 ' HB ' ' A' ' 101' ' ' ILE . 19.2 mt -73.46 1.21 10.29 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -170.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.0 m -121.73 27.78 7.99 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.118 0.967 . . . . 0.0 110.954 174.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -139.4 95.96 3.02 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 -170.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.2 -25.53 33.51 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.131 0.972 . . . . 0.0 112.618 -172.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -63.51 -44.18 95.05 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 123.064 0.546 . . . . 0.0 110.076 175.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.3 -40.82 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 C-N-CA 125.087 1.355 . . . . 0.0 109.887 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 6.8 mp -51.41 -43.39 61.95 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 119.712 1.142 . . . . 0.0 111.678 -178.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -69.93 -36.81 75.61 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.75 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -63.76 -41.55 97.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 119.107 0.867 . . . . 0.0 108.831 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 6.8 mt -67.17 -52.93 35.34 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 60.9 mt -62.38 -14.68 42.69 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 63.5 p -116.87 5.48 12.99 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.391 1.076 . . . . 0.0 111.83 178.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.38 115.74 3.46 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.14 0.976 . . . . 0.0 109.37 177.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.5 m -87.96 -4.79 58.78 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.206 1.002 . . . . 0.0 111.933 -177.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.6 p -152.84 163.08 40.42 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.547 0.739 . . . . 0.0 110.08 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 58.8 mp0 -58.32 -37.64 75.52 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 123.943 0.897 . . . . 0.0 109.819 169.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -58.05 -45.97 86.17 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-O 119.359 -0.353 . . . . 0.0 110.356 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -65.38 -26.55 68.05 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 118.608 -0.71 . . . . 0.0 112.905 177.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 49.5 mt -72.69 -48.29 40.19 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 120.305 1.412 . . . . 0.0 109.0 172.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.09 -26.84 69.02 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 177.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -58.73 -37.97 77.34 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.007 -1.058 . . . . 0.0 110.607 172.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 67.6 mt -74.29 -36.26 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 124.018 0.927 . . . . 0.0 109.512 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ILE . . . . . 0.55 HD11 HD22 ' A' ' 81' ' ' LEU . 33.3 mm -55.16 -48.93 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 169.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.2 m -67.91 -26.62 66.07 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.367 -171.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 23.7 ttm105 -79.27 -16.03 57.06 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 126.852 2.061 . . . . 0.0 111.728 177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.91 0 N-CA-C 108.688 -1.765 . . . . 0.0 108.688 174.569 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tpt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.564 0.221 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -65.47 116.9 7.23 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.54 HD23 ' HA3' ' A' ' 147' ' ' GLY . 4.0 mm? -59.15 -39.05 81.23 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.651 0.78 . . . . 0.0 110.023 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.9 p -59.55 -14.97 15.2 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 124.937 1.295 . . . . 0.0 112.025 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -84.0 -27.14 28.63 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 123.951 0.901 . . . . 0.0 113.404 174.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -96.95 -39.01 9.58 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 122.889 0.476 . . . . 0.0 111.393 -174.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.43 ' CE2' HD11 ' A' ' 12' ' ' ILE . 0.1 OUTLIER -89.03 127.02 57.22 Favored Pre-proline 0 CA--C 1.551 0.997 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -173.519 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -69.44 -76.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 122.552 2.168 . . . . 0.0 113.131 -170.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' A' ' 11' ' ' SER . 32.1 tt0 -166.39 -62.08 0.03 OUTLIER 'General case' 0 C--O 1.231 0.107 0 C-N-CA 125.317 1.447 . . . . 0.0 109.886 -177.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.04 11.75 0.28 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.93 1.692 . . . . 0.0 112.149 175.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.422 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -68.87 -23.33 64.2 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 126.938 2.095 . . . . 0.0 111.429 -169.642 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.447 HG13 ' HB2' ' A' ' 141' ' ' ALA . 13.6 mm -98.99 139.34 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.298 0 C-N-CA 124.604 1.161 . . . . 0.0 108.016 -169.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 m -158.91 128.46 5.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 118.398 0.545 . . . . 0.0 109.857 169.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 p -96.74 142.94 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 105.613 -1.995 . . . . 0.0 105.613 168.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 15' ' ' ILE . 21.4 mt -138.31 148.61 24.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 -169.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -65.72 -48.72 71.01 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.451 -0.781 . . . . 0.0 110.309 169.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -169.67 148.46 3.66 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 105.334 -2.099 . . . . 0.0 105.334 -178.315 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.34 153.47 42.33 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 171.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -54.49 -43.23 71.61 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.381 0.673 . . . . 0.0 110.093 173.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -163.58 177.07 9.08 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 126.938 2.095 . . . . 0.0 107.765 169.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -54.81 -36.39 64.91 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 126.285 1.834 . . . . 0.0 113.937 175.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.408 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.8 mt-30 -62.52 -49.79 73.94 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 120.328 1.422 . . . . 0.0 108.459 171.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -60.65 -31.46 70.68 Favored 'General case' 0 C--O 1.222 -0.362 0 O-C-N 122.067 -0.396 . . . . 0.0 111.833 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.57 83.17 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.473 -0.767 . . . . 0.0 110.221 -178.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.3 -45.06 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 169.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -57.4 -46.56 83.33 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 122.959 0.503 . . . . 0.0 110.163 -176.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -63.43 -36.15 82.78 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.976 1.31 . . . . 0.0 111.771 172.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.5 m -62.66 -21.38 65.67 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.636 1.107 . . . . 0.0 112.504 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.7 mmt -122.43 -18.82 6.6 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -169.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.7 p -60.88 -35.92 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 121.152 1.796 . . . . 0.0 111.74 -171.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -67.16 -21.58 65.8 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.968 0.804 . . . . 0.0 111.998 179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.8 mt -83.41 -43.97 15.31 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.166 0.986 . . . . 0.0 108.658 171.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 34.2 tp -57.19 -42.85 82.01 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.331 1.052 . . . . 0.0 111.038 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.91 -30.14 67.6 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 126.271 1.829 . . . . 0.0 113.256 -176.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -108.93 20.73 18.11 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.377 0.0 OUTLIER 42.4 38.48 1.22 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.379 2.272 . . . . 0.0 115.38 -172.533 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -66.19 -21.18 66.31 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.416 -0.802 . . . . 0.0 110.081 168.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.1 pt -149.05 175.91 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 127.074 2.15 . . . . 0.0 108.488 -173.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.5 p -113.58 166.33 11.63 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.458 1.503 . . . . 0.0 108.486 169.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.46 -28.16 69.78 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.023 -1.048 . . . . 0.0 111.327 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -61.49 -38.08 86.0 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 121.679 -0.638 . . . . 0.0 111.301 176.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -57.11 -48.0 79.7 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.607 0.763 . . . . 0.0 109.85 178.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.0 mt -59.04 -50.39 79.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 124.99 1.316 . . . . 0.0 109.04 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -68.05 -27.34 66.43 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.954 -174.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.96 -43.38 86.42 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.4 1.0 . . . . 0.0 110.651 172.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 18.3 mt -68.06 -49.39 68.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.408 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 86.3 mttt -60.24 -47.09 87.46 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -174.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.64 -44.17 94.63 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.607 0.763 . . . . 0.0 110.923 -175.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.6 m -63.01 -44.5 95.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.989 0.516 . . . . 0.0 110.02 175.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.9 m . . . . . 0 CA--C 1.537 0.453 0 C-N-CA 123.759 0.824 . . . . 0.0 111.516 176.496 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 . . . . . 0 N--CA 1.454 -0.241 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 50.1 mm -128.58 143.64 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 105.494 -2.039 . . . . 0.0 105.494 -177.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 mp -132.02 -31.51 1.48 Allowed 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -169.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -163.53 163.45 16.38 Favored Pre-proline 0 C--O 1.236 0.351 0 C-N-CA 124.881 1.272 . . . . 0.0 107.596 -175.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.25 112.01 0.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.25 2.633 . . . . 0.0 111.846 171.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.17 4.69 77.54 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-O 117.471 -1.738 . . . . 0.0 114.618 176.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.49 126.89 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 119.977 1.889 . . . . 0.0 109.572 -169.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.76 171.01 12.11 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 125.879 1.672 . . . . 0.0 109.875 177.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.587 ' HE2' HD12 ' A' ' 122' ' ' LEU . 9.1 ttm -146.72 66.17 10.53 Favored Pre-proline 0 CA--C 1.54 0.578 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -50.67 137.05 42.08 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 121.178 1.252 . . . . 0.0 112.972 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -177.56 155.75 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 129.776 3.23 . . . . 0.0 105.279 -170.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.11 163.44 30.81 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.557 1.143 . . . . 0.0 108.336 171.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -52.11 139.08 35.22 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-O 118.024 -0.988 . . . . 0.0 109.413 175.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -44.67 -47.91 10.98 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.961 3.107 . . . . 0.0 113.335 -177.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -69.11 -4.26 16.56 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -175.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 73.7 m -78.94 -4.32 49.27 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.233 -0.917 . . . . 0.0 111.976 172.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 136.62 13.64 0.96 Allowed Glycine 0 CA--C 1.526 0.747 0 CA-C-N 119.485 1.039 . . . . 0.0 114.135 174.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.73 147.74 52.23 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 119.566 1.683 . . . . 0.0 108.804 169.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.2 mt -131.23 -31.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.65 1.18 . . . . 0.0 110.197 -175.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -144.91 154.61 42.79 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.311 1.444 . . . . 0.0 108.522 175.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 37.5 m -86.64 129.68 34.78 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 123.394 0.678 . . . . 0.0 109.886 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.23 -175.75 38.72 Favored Glycine 0 CA--C 1.527 0.808 0 C-N-CA 123.816 0.722 . . . . 0.0 111.313 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 49.5 mtp -145.09 170.14 16.77 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.242 1.417 . . . . 0.0 110.844 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 33.0 m -157.27 173.34 17.09 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.165 1.786 . . . . 0.0 108.701 170.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.3 tp -148.21 116.45 6.51 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.071 1.348 . . . . 0.0 110.904 -168.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 87.8 m -118.37 143.68 46.47 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 125.081 1.352 . . . . 0.0 108.746 -177.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -134.85 143.44 47.01 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 171.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.4 mp -121.72 133.08 54.94 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.124 1.77 . . . . 0.0 106.313 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -67.14 -48.04 69.24 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.793 -0.567 . . . . 0.0 110.913 177.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -88.1 -15.95 34.83 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.555 0.742 . . . . 0.0 112.001 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.92 -178.21 21.27 Favored Glycine 0 CA--C 1.532 1.1 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -168.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -145.32 167.57 9.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 169.255 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -121.5 93.35 3.98 Favored 'General case' 0 C--N 1.333 -0.12 0 O-C-N 121.805 -0.56 . . . . 0.0 110.799 -169.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 . . . . . 0 CA--C 1.538 0.515 0 C-N-CA 123.743 0.817 . . . . 0.0 110.616 169.96 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo . . . . . 0 CA--C 1.534 0.52 0 CA-C-O 121.401 0.501 . . . . 0.0 111.7 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.7 mm -113.49 138.32 43.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 21.3 mtpp -112.05 -19.63 12.25 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 117.291 -1.338 . . . . 0.0 111.03 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.6 tp -133.66 131.71 39.85 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 120.218 1.372 . . . . 0.0 109.424 -170.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.6 mp -138.4 135.1 34.94 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -175.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.438 ' HB ' HD11 ' A' ' 122' ' ' LEU . 2.0 mt -113.12 127.84 70.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 169.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.22 145.89 25.91 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 107.634 -2.186 . . . . 0.0 107.634 169.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.402 HD12 HD23 ' A' ' 118' ' ' LEU . 6.9 tt -143.62 132.6 22.84 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 169.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 85.3 p -124.39 153.39 41.94 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 169.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -152.87 133.06 13.51 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 118.343 0.52 . . . . 0.0 110.189 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.24 -22.06 58.16 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.024 0.53 . . . . 0.0 111.938 177.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -148.65 156.32 42.24 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.311 1.044 . . . . 0.0 109.642 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.41 -34.49 72.53 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -177.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.64 -30.94 61.8 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 120.749 -1.219 . . . . 0.0 111.065 177.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.1 m -67.16 -37.1 83.19 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.632 -0.668 . . . . 0.0 110.342 171.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -59.04 -49.02 79.48 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 123.857 0.863 . . . . 0.0 109.585 170.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 14.7 mm -54.29 -49.62 62.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 176.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.16 -42.79 97.32 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-N 119.199 0.908 . . . . 0.0 112.478 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.42 -40.47 67.09 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.398 0.679 . . . . 0.0 111.199 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.455 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 8.4 mm -58.03 -47.0 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 C-N-CA 125.391 1.477 . . . . 0.0 107.501 173.134 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -67.74 0.15 3.55 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.347 1.459 . . . . 0.0 112.661 178.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -100.3 -54.76 2.78 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 124.824 1.25 . . . . 0.0 107.868 169.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.457 HD12 ' N ' ' A' ' 119' ' ' SER . 1.4 pp -64.43 -21.68 66.72 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -178.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' SER . . . . . 0.457 ' N ' HD12 ' A' ' 118' ' ' LEU . 54.5 p -59.39 -30.39 68.41 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 123.62 0.768 . . . . 0.0 111.844 175.772 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -70.14 -11.15 60.68 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.545 -0.722 . . . . 0.0 110.975 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.517 ' HA ' HG21 ' A' ' 127' ' ' ILE . 35.2 mt -110.64 -63.62 1.37 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.115 0.966 . . . . 0.0 111.008 176.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.587 HD12 ' HE2' ' A' ' 65' ' ' MET . 17.1 mt -70.6 -17.3 62.9 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -172.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.1 m -111.85 27.78 9.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.597 0.759 . . . . 0.0 110.402 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -132.8 97.7 4.11 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 107.227 -1.397 . . . . 0.0 107.227 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -57.85 -28.33 64.02 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.232 -175.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -67.27 -42.55 83.68 Favored 'General case' 0 C--O 1.23 0.072 0 CA-C-O 121.303 0.573 . . . . 0.0 109.772 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.517 HG21 ' HA ' ' A' ' 121' ' ' LEU . 1.2 mp -69.05 -42.94 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.484 HD21 ' HA ' ' A' ' 122' ' ' LEU . 40.2 mt -54.09 -44.98 71.66 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 118.893 -0.575 . . . . 0.0 111.061 -175.817 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -69.7 -34.99 74.69 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 118.244 0.475 . . . . 0.0 110.109 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -72.28 -35.22 68.66 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.946 0.794 . . . . 0.0 109.883 -177.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 28.9 mt -67.28 -52.15 44.16 Favored 'General case' 0 C--O 1.225 -0.203 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 170.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.4 -24.66 56.79 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 66.9 p -105.46 5.33 31.49 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.737 1.215 . . . . 0.0 112.122 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -56.5 116.45 3.11 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 119.181 0.9 . . . . 0.0 110.413 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.3 m -68.63 -29.39 67.88 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 125.354 1.462 . . . . 0.0 111.342 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 33.1 m -147.68 164.33 33.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.971 1.309 . . . . 0.0 109.855 -169.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -54.6 -39.08 67.49 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.14 1.376 . . . . 0.0 110.389 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -56.08 -39.89 72.8 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.939 0.896 . . . . 0.0 112.389 -176.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -61.45 -43.99 97.89 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 118.824 0.738 . . . . 0.0 110.851 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.6 mt -62.87 -49.54 74.43 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -178.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.447 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -60.05 -27.89 67.33 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 174.494 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -81.24 -39.43 25.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 119.05 0.841 . . . . 0.0 110.6 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 63.4 mt -66.95 -33.0 60.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 123.958 0.903 . . . . 0.0 109.253 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 1.1 mm -48.37 -47.77 14.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.75 1.22 . . . . 0.0 111.287 169.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 16.3 m -66.18 -18.61 65.45 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.789 0.836 . . . . 0.0 112.562 -169.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 32.1 ttp85 -53.82 -35.67 61.68 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.696 1.198 . . . . 0.0 112.93 173.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' GLY . . . . . 0.54 ' HA3' HD23 ' A' ' 3' ' ' LEU . . . . . . . . 0 C--O 1.247 0.953 0 N-CA-C 107.876 -2.09 . . . . 0.0 107.876 -173.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.872 0.367 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.44 ' HD2' ' HA ' ' A' ' 2' ' ' ARG . 6.3 mmm180 -68.12 114.18 6.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.164 -175.018 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.0 -34.35 74.67 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.754 175.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.1 m -55.16 -15.92 2.68 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.0 0.818 . . . . 0.0 113.079 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -62.38 -23.32 66.74 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 172.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -106.5 -19.1 13.78 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -169.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -105.58 100.46 26.79 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 120.657 1.571 . . . . 0.0 107.589 -169.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -59.51 -67.41 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.462 2.775 . . . . 0.0 114.135 -170.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -162.26 -72.98 0.05 Allowed 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 123.78 0.832 . . . . 0.0 111.485 -174.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.7 m -67.75 2.6 1.83 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.559 1.144 . . . . 0.0 112.009 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.52 -14.84 63.28 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.825 1.65 . . . . 0.0 112.745 -169.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.4 mt -117.8 130.35 72.81 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 105.123 -2.177 . . . . 0.0 105.123 -169.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 75.8 m -156.9 149.38 23.31 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.51 0.671 . . . . 0.0 111.231 -177.675 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.4 t -117.96 141.38 37.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 105.632 -1.988 . . . . 0.0 105.632 169.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.2 mt -135.37 145.01 32.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 125.602 1.561 . . . . 0.0 107.767 -169.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -68.19 -36.3 79.37 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.878 -0.514 . . . . 0.0 111.909 176.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 p -179.54 146.61 0.28 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.802 2.041 . . . . 0.0 106.346 -177.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.79 154.12 36.47 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 169.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.53 -42.94 83.89 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.215 0.606 . . . . 0.0 109.778 174.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -166.07 177.88 6.72 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 128.34 2.656 . . . . 0.0 107.29 172.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.46 -37.49 65.27 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 126.352 1.861 . . . . 0.0 114.015 175.354 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.446 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.1 mt-30 -62.03 -50.4 72.17 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.316 1.416 . . . . 0.0 108.364 172.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -60.04 -31.33 69.86 Favored 'General case' 0 C--O 1.222 -0.348 0 O-C-N 122.039 -0.413 . . . . 0.0 111.808 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.24 -38.01 84.48 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.582 -0.699 . . . . 0.0 110.234 -179.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.9 -45.35 91.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 169.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -56.69 -44.87 81.92 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 122.696 0.398 . . . . 0.0 110.208 -176.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -69.42 -28.29 66.01 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.758 1.223 . . . . 0.0 112.466 174.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m -64.71 -20.94 66.61 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.953 1.251 . . . . 0.0 111.53 170.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.4 mmt -122.69 -21.47 5.63 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -169.084 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -59.26 -35.27 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 120.944 1.702 . . . . 0.0 112.16 -169.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.5 m -64.43 -30.97 72.0 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.039 0.836 . . . . 0.0 111.417 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.7 mt -77.41 -43.22 33.33 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.807 0.843 . . . . 0.0 108.821 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 28.3 tp -56.67 -41.42 77.22 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.825 0.85 . . . . 0.0 110.956 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.61 -29.1 68.35 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 124.992 1.317 . . . . 0.0 112.78 -171.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -99.71 16.45 23.49 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.09 0.405 . . . . 0.0 110.654 172.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.336 3.4 p30 44.9 46.54 9.02 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.969 1.708 . . . . 0.0 114.167 -171.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -72.73 -19.96 61.29 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.596 -0.69 . . . . 0.0 109.14 167.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 pt -142.36 172.99 7.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 127.242 2.217 . . . . 0.0 108.531 -178.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m -108.23 159.03 16.94 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.165 1.786 . . . . 0.0 108.195 170.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -60.75 -33.72 73.36 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.86 -1.15 . . . . 0.0 111.74 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -62.34 -25.63 68.0 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.273 -0.892 . . . . 0.0 113.091 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -63.3 -45.73 90.01 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 119.521 1.055 . . . . 0.0 109.591 174.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.7 mt -59.9 -51.26 74.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 124.75 1.22 . . . . 0.0 108.816 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -68.75 -24.54 64.46 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.718 -174.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.5 -42.52 82.92 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.661 1.119 . . . . 0.0 110.765 172.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 14.9 mt -69.86 -49.22 58.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.446 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.8 mttt -59.81 -42.16 92.83 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -174.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -60.42 -48.07 83.37 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.734 0.814 . . . . 0.0 111.532 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.6 m -62.55 -43.32 99.1 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.309 0.504 . . . . 0.0 110.456 176.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 42.1 m . . . . . 0 CA--C 1.541 0.613 0 C-N-CA 123.527 0.731 . . . . 0.0 111.29 178.397 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 C--O 1.225 -0.208 0 N-CA-C 109.311 -0.625 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.5 mm -118.02 138.71 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -124.18 -33.36 3.09 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.255 0.622 . . . . 0.0 112.183 -169.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.51 164.19 20.0 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 124.844 1.258 . . . . 0.0 107.794 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -46.32 112.72 0.5 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.412 2.741 . . . . 0.0 111.997 172.472 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.41 5.38 85.04 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-O 117.792 -1.56 . . . . 0.0 114.677 176.511 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.9 t -127.26 122.92 60.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 120.066 1.933 . . . . 0.0 108.896 -169.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.71 171.1 10.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.802 1.641 . . . . 0.0 109.998 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.492 ' CE ' HD11 ' A' ' 118' ' ' LEU . 9.1 ttm -141.31 58.76 9.31 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 123.997 0.919 . . . . 0.0 111.516 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -56.32 128.12 28.83 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 121.807 1.671 . . . . 0.0 110.535 -176.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -179.11 162.69 1.24 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 127.809 2.444 . . . . 0.0 106.719 -169.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.83 171.79 13.91 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.791 1.237 . . . . 0.0 109.237 -175.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 -57.71 154.09 27.94 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-O 118.375 -0.822 . . . . 0.0 109.632 171.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.38 -40.17 83.74 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.499 2.132 . . . . 0.0 109.488 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.67 -16.97 30.29 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.948 2.099 . . . . 0.0 113.179 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 84.2 m -77.1 -9.41 58.72 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.736 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 135.78 17.26 0.84 Allowed Glycine 0 C--N 1.34 0.775 0 CA-C-O 118.234 -1.315 . . . . 0.0 113.859 175.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 148.42 51.78 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.435 1.617 . . . . 0.0 109.358 172.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.8 mt -129.24 -33.98 1.89 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 124.459 1.103 . . . . 0.0 110.685 -175.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -146.7 159.78 43.04 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.267 1.427 . . . . 0.0 108.524 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 85.2 m -92.47 125.47 37.13 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 123.379 0.672 . . . . 0.0 111.986 -175.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.62 -178.5 42.77 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 125.104 1.335 . . . . 0.0 111.294 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 13.1 mtm -147.36 169.79 18.71 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.962 1.705 . . . . 0.0 111.778 -176.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -136.88 161.02 37.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.503 1.921 . . . . 0.0 108.829 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 33.4 tp -143.03 106.28 4.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.818 2.047 . . . . 0.0 108.122 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.1 m -121.41 136.21 54.98 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -170.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tt -132.99 136.57 46.13 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 119.348 0.977 . . . . 0.0 108.404 175.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.0 mp -113.95 126.74 55.49 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 125.54 1.536 . . . . 0.0 107.311 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -61.78 -40.77 96.33 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.323 0.649 . . . . 0.0 110.892 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -96.35 -10.75 27.03 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.829 0.851 . . . . 0.0 112.175 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 61.3 -173.74 6.53 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -169.002 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -150.27 168.27 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 168.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -125.94 92.42 3.59 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 121.5 0.666 . . . . 0.0 110.203 -170.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 . . . . . 0 CA--C 1.537 0.45 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.337 171.516 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo . . . . . 0 N--CA 1.459 -0.504 0 CA-C-O 121.241 0.434 . . . . 0.0 111.453 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.0 mm -113.55 137.4 46.79 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -114.01 -15.13 12.35 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 116.519 -1.705 . . . . 0.0 111.146 175.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.514 HD13 HD13 ' A' ' 131' ' ' LEU . 0.6 OUTLIER -138.73 144.06 39.33 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 121.249 1.841 . . . . 0.0 111.982 175.171 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -139.37 109.79 6.57 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.654 1.582 . . . . 0.0 107.386 -173.003 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.457 ' HB ' HD11 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -84.9 135.6 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 168.865 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -97.88 154.81 20.32 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 109.218 -1.553 . . . . 0.0 109.218 170.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.519 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -152.11 144.54 24.1 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 173.511 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.519 ' N ' HD23 ' A' ' 103' ' ' LEU . 82.5 p -142.53 145.05 33.23 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 168.097 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.643 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -144.1 146.91 33.11 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 119.27 0.941 . . . . 0.0 109.642 169.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.01 -14.56 59.12 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.483 -176.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -136.97 151.0 48.51 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.436 0.694 . . . . 0.0 110.202 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.43 -35.38 77.4 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -72.6 -30.39 64.32 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 121.139 -0.976 . . . . 0.0 110.917 176.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.43 ' HB2' ' HB1' ' A' ' 105' ' ' ALA . 19.6 m -66.46 -36.45 82.81 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.383 169.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.643 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 27.3 m-70 -61.55 -45.79 92.66 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 119.303 0.956 . . . . 0.0 109.969 170.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 20.8 mm -55.7 -51.76 55.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 118.985 0.811 . . . . 0.0 109.274 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.26 -41.8 96.97 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-N 118.854 0.752 . . . . 0.0 111.669 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.37 -43.68 73.08 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.492 0.717 . . . . 0.0 111.22 -179.082 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.8 mm -59.11 -46.47 91.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 C-N-CA 124.847 1.259 . . . . 0.0 108.282 175.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -68.03 -12.05 60.1 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.352 -0.843 . . . . 0.0 111.562 -178.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -91.52 -50.16 5.93 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 124.216 1.006 . . . . 0.0 109.089 173.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.492 HD11 ' CE ' ' A' ' 65' ' ' MET . 4.2 pp -69.01 -26.81 65.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 121.69 -0.631 . . . . 0.0 111.478 -176.349 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.8 m -62.16 -22.18 65.66 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 119.118 -0.467 . . . . 0.0 112.168 173.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -65.97 -16.7 64.12 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.396 0.998 . . . . 0.0 110.336 172.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 34.1 mt -106.3 -60.91 1.59 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.612 1.565 . . . . 0.0 110.115 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.488 HD12 ' HE2' ' A' ' 65' ' ' MET . 13.6 mt -69.15 -17.51 63.83 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -173.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 44.3 m -113.03 27.38 9.67 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 119.046 0.839 . . . . 0.0 110.595 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -139.31 96.87 3.17 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 -170.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.44 -25.77 38.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.296 1.038 . . . . 0.0 112.737 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.34 -45.8 89.54 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.373 0.606 . . . . 0.0 109.896 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -72.15 -38.21 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.761 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.3 mt -59.06 -33.37 70.71 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 119.312 0.96 . . . . 0.0 111.468 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -68.27 -43.34 78.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 120.858 -1.151 . . . . 0.0 110.334 172.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -64.73 -33.36 75.78 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.599 0.636 . . . . 0.0 110.665 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.514 HD13 HD13 ' A' ' 99' ' ' LEU . 2.6 pp -78.11 -45.41 23.44 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.119 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 53.8 mt -62.97 -24.03 67.7 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 120.225 1.375 . . . . 0.0 112.395 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 52.4 p -94.36 1.0 55.89 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.984 0.914 . . . . 0.0 111.646 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.96 107.67 2.76 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.131 0.878 . . . . 0.0 110.944 -176.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.2 p -77.42 -24.24 50.47 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.776 1.23 . . . . 0.0 112.208 176.188 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 29.8 m -147.55 157.47 43.57 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.86 0.864 . . . . 0.0 111.32 -169.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -50.04 -42.25 49.22 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.963 2.105 . . . . 0.0 111.643 177.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -70.57 -21.97 62.63 Favored 'General case' 0 CA--C 1.527 0.081 0 O-C-N 121.452 -0.78 . . . . 0.0 112.559 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -76.42 -32.2 58.36 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 120.163 1.347 . . . . 0.0 109.468 173.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.48 -43.42 76.99 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.269 -0.894 . . . . 0.0 108.642 174.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -56.44 -38.93 72.29 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 170.192 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.18 -39.01 91.29 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 119.154 0.888 . . . . 0.0 111.191 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 86.4 mt -62.03 -43.48 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.453 0.701 . . . . 0.0 109.578 175.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 18.0 mm -58.92 -43.56 88.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 C-N-CA 122.792 0.437 . . . . 0.0 110.299 176.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 52.3 m -72.67 -26.75 61.74 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 122.017 -0.427 . . . . 0.0 111.831 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 -70.06 -40.43 75.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.305 1.042 . . . . 0.0 110.049 174.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 C-N-CA 124.639 1.114 . . . . 0.0 110.477 -174.623 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 N--CA 1.485 1.312 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -62.31 113.08 2.7 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 168.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -53.49 -43.34 68.16 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.146 0.978 . . . . 0.0 108.794 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -54.05 -21.62 8.81 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.158 1.383 . . . . 0.0 113.69 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.99 -26.12 68.03 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.73 1.15 . . . . 0.0 112.659 173.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -97.85 -22.33 16.42 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 118.132 -0.937 . . . . 0.0 113.377 -171.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -104.04 101.16 24.11 Favored Pre-proline 0 N--CA 1.473 0.702 0 N-CA-C 105.342 -2.096 . . . . 0.0 105.342 -173.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.01 -77.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.075 2.517 . . . . 0.0 113.344 -169.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -159.54 160.09 34.12 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 127.146 2.178 . . . . 0.0 105.696 174.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 m 60.47 1.4 0.39 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.587 1.555 . . . . 0.0 112.99 -177.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.26 -7.63 55.32 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 127.543 2.337 . . . . 0.0 112.766 -169.543 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.5 mt -120.42 129.41 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.935 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -169.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.7 p -147.67 146.88 29.47 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.495 0.664 . . . . 0.0 112.093 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 93.7 t -127.47 136.52 60.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 171.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.0 mt -139.56 150.73 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 125.981 1.713 . . . . 0.0 106.906 -169.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 55.3 t60 -75.3 -48.78 21.6 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.838 -0.539 . . . . 0.0 109.718 172.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.1 p -157.27 150.15 23.45 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 178.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.68 156.04 26.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 170.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -59.59 -31.21 69.26 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.161 175.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -166.37 173.7 9.75 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 126.844 2.057 . . . . 0.0 107.704 177.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 1.2 p90 -64.12 -33.44 75.77 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 123.747 0.819 . . . . 0.0 111.501 169.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.423 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.5 mt-30 -59.23 -48.83 80.16 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 169.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.34 -30.89 71.78 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 122.048 -0.408 . . . . 0.0 111.438 -179.159 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.96 -36.8 83.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.529 -0.732 . . . . 0.0 110.026 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.32 -45.64 92.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 169.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -56.65 -45.92 81.35 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.766 0.427 . . . . 0.0 110.296 -177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -67.14 -31.04 71.21 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.872 1.269 . . . . 0.0 112.172 174.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.1 m -64.61 -21.81 66.81 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.875 1.216 . . . . 0.0 111.979 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.6 mmt -123.36 -20.48 5.61 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -169.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -60.99 -34.18 58.78 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-N 121.03 1.741 . . . . 0.0 111.595 -171.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.0 m -62.35 -26.44 68.45 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.778 0.717 . . . . 0.0 111.755 178.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.0 mt -84.83 -40.97 16.52 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.105 0.962 . . . . 0.0 109.179 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.3 tp -56.4 -40.92 75.44 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.775 0.83 . . . . 0.0 110.828 178.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -66.62 -25.44 66.6 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 125.827 1.651 . . . . 0.0 113.788 -171.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -110.82 23.62 13.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.768 0.427 . . . . 0.0 110.019 172.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.305 3.7 p30 45.39 43.06 8.2 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.483 1.513 . . . . 0.0 114.191 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.458 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 41.5 m-85 -71.18 -18.4 62.49 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.329 -0.857 . . . . 0.0 109.076 168.104 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 pt -145.8 170.77 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.323 2.249 . . . . 0.0 108.734 -178.376 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.4 m -107.44 161.19 15.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.052 1.741 . . . . 0.0 108.071 169.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -61.32 -30.94 70.81 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.066 -1.021 . . . . 0.0 112.349 -174.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -57.15 -36.2 70.45 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.686 -0.634 . . . . 0.0 111.823 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -58.07 -45.16 87.56 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 123.834 0.854 . . . . 0.0 110.319 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.7 mt -61.83 -50.7 79.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 124.771 1.228 . . . . 0.0 108.486 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -68.29 -26.57 65.71 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 118.089 -0.958 . . . . 0.0 111.924 -174.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.77 -44.91 86.52 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.491 1.041 . . . . 0.0 110.477 173.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.6 mt -69.28 -48.55 67.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 86.7 mttt -58.75 -47.68 83.81 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -175.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.79 -44.04 94.55 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 123.996 0.918 . . . . 0.0 111.012 -176.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -61.22 -44.06 97.88 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 122.743 0.417 . . . . 0.0 110.129 176.011 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.1 m . . . . . 0 CA--C 1.534 0.336 0 C-N-CA 124.07 0.948 . . . . 0.0 111.164 178.855 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 . . . . . 0 N--CA 1.454 -0.274 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.6 mm -124.14 141.5 44.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 mp -130.38 -28.39 2.1 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -169.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.13 161.03 26.54 Favored Pre-proline 0 C--O 1.237 0.396 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -56.72 114.52 1.95 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.017 1.811 . . . . 0.0 109.238 172.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.14 -4.87 57.41 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-O 117.792 -1.56 . . . . 0.0 114.2 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.1 t -129.22 128.53 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.93 1.865 . . . . 0.0 110.212 -169.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -131.67 167.39 19.54 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.292 1.837 . . . . 0.0 109.938 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.448 ' CE ' HD11 ' A' ' 118' ' ' LEU . 8.8 ttm -139.94 57.12 8.87 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.006 0.922 . . . . 0.0 112.151 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -45.81 138.08 11.97 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 121.863 1.709 . . . . 0.0 114.175 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 178.44 154.88 0.39 Allowed 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 129.121 2.968 . . . . 0.0 105.67 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -133.72 161.43 34.71 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 170.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -56.64 149.36 41.54 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-O 118.687 -0.673 . . . . 0.0 109.351 178.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -47.72 -41.01 31.54 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 123.131 2.554 . . . . 0.0 112.767 -177.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -62.74 -15.44 53.12 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.352 1.461 . . . . 0.0 113.285 -177.215 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 84.7 m -79.8 -2.01 41.4 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.86 0.864 . . . . 0.0 111.705 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.99 20.07 1.51 Allowed Glycine 0 CA--C 1.523 0.548 0 CA-C-O 118.493 -1.171 . . . . 0.0 112.941 174.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.39 148.91 48.97 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 119.415 1.607 . . . . 0.0 108.665 169.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.7 mt -129.53 -33.69 1.85 Allowed 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.259 1.024 . . . . 0.0 110.529 -176.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.458 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 73.7 mttt -145.67 153.85 41.46 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 125.281 1.432 . . . . 0.0 107.694 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.7 m -84.8 126.55 33.53 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 122.854 0.462 . . . . 0.0 109.985 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.95 179.67 42.13 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.665 1.126 . . . . 0.0 110.385 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 60.3 mtp -147.82 168.47 22.1 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.298 1.039 . . . . 0.0 112.767 -173.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -138.65 164.14 30.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.251 1.821 . . . . 0.0 109.441 174.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.458 HD22 HD11 ' A' ' 144' ' ' ILE . 31.3 tp -146.77 100.93 3.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.135 2.174 . . . . 0.0 108.837 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.497 ' O ' HD22 ' A' ' 99' ' ' LEU . 92.2 m -117.27 135.19 54.0 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.316 1.046 . . . . 0.0 109.407 -172.689 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.4 tp -124.99 139.22 54.01 Favored 'General case' 0 CA--C 1.526 0.036 0 C-N-CA 123.795 0.838 . . . . 0.0 108.833 174.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mp -118.3 126.41 52.07 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 126.519 1.928 . . . . 0.0 105.828 175.127 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -72.23 -35.23 68.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 119.039 0.836 . . . . 0.0 112.31 -178.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 52.1 mm-40 -81.07 -20.08 42.33 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.633 0.773 . . . . 0.0 111.241 172.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 65.2 -174.5 16.5 Favored Glycine 0 CA--C 1.532 1.142 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 -168.016 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -146.7 165.38 7.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 105.779 -1.934 . . . . 0.0 105.779 168.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -126.75 94.3 4.01 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -169.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 124.478 1.111 . . . . 0.0 110.948 174.844 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo . . . . . 0 N--CA 1.46 -0.447 0 CA-C-O 121.597 0.582 . . . . 0.0 112.558 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 40.5 mm -116.82 132.4 66.64 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 106.97 -1.493 . . . . 0.0 106.97 178.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -98.63 -35.48 10.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 117.658 -1.163 . . . . 0.0 109.55 169.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.497 HD22 ' O ' ' A' ' 82' ' ' THR . 3.2 tm? -115.51 129.96 56.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 119.804 1.184 . . . . 0.0 110.512 -169.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mp -131.38 104.74 7.18 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.513 ' HB ' HD11 ' A' ' 122' ' ' LEU . 0.5 OUTLIER -80.27 138.96 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 168.878 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -99.42 148.88 18.81 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 108.312 -1.915 . . . . 0.0 108.312 169.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.75 137.55 25.21 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.001 -1.851 . . . . 0.0 106.001 169.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 92.6 p -132.07 147.44 52.44 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 126.305 1.842 . . . . 0.0 106.188 168.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -148.0 133.6 18.79 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -178.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.15 -18.53 59.08 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.239 -0.41 . . . . 0.0 111.781 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -144.25 153.38 41.98 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.852 0.861 . . . . 0.0 110.079 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.17 -35.23 74.88 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.224 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.48 -31.12 62.1 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 120.933 -1.104 . . . . 0.0 111.086 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.9 m -64.63 -39.2 93.29 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.845 -0.534 . . . . 0.0 110.261 170.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -58.55 -49.97 75.48 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 123.508 0.723 . . . . 0.0 109.798 171.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 16.4 mm -55.29 -52.13 48.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.94 -41.0 99.19 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 118.971 0.805 . . . . 0.0 111.761 -176.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.27 -46.61 73.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.483 0.713 . . . . 0.0 110.725 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.2 mm -57.72 -46.71 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 124.853 1.261 . . . . 0.0 108.632 176.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -68.21 -14.91 63.34 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.299 -0.876 . . . . 0.0 111.512 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -90.15 -47.38 7.84 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 123.895 0.878 . . . . 0.0 109.539 174.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.448 HD11 ' CE ' ' A' ' 65' ' ' MET . 4.3 pp -70.58 -25.83 63.25 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 121.75 -0.594 . . . . 0.0 111.51 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.0 m -60.77 -21.99 63.61 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 172.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.72 -17.13 64.7 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.35 0.977 . . . . 0.0 110.268 173.29 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 44.9 mt -105.71 -61.85 1.44 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.26 1.424 . . . . 0.0 109.883 177.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.513 HD11 ' HB ' ' A' ' 101' ' ' ILE . 16.6 mt -68.97 -12.73 61.93 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -173.213 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.3 m -118.38 29.04 7.99 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.993 0.815 . . . . 0.0 110.4 177.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -131.86 99.71 4.84 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.577 1.151 . . . . 0.0 108.052 175.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -57.47 -25.6 59.96 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.038 -0.983 . . . . 0.0 112.488 -176.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -62.68 -48.98 76.91 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.139 0.576 . . . . 0.0 109.822 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.64 -41.26 85.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 123.9 0.88 . . . . 0.0 108.814 178.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 122' ' ' LEU . 34.5 mt -53.91 -43.44 69.73 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 118.64 0.655 . . . . 0.0 111.605 -172.144 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -69.87 -32.31 70.6 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.449 0.568 . . . . 0.0 110.234 -178.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -71.18 -36.68 72.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -178.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 48.6 mt -62.24 -55.57 27.13 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 169.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 58.2 mt -62.42 -9.43 8.35 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -172.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 67.9 p -121.78 4.83 10.0 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.342 1.457 . . . . 0.0 111.546 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.53 113.01 2.21 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.054 0.942 . . . . 0.0 110.527 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.1 m -75.16 -22.49 58.07 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.632 0.773 . . . . 0.0 111.942 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.2 m -147.13 155.49 42.19 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.867 0.867 . . . . 0.0 109.895 -169.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -62.18 -31.93 72.49 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 123.775 0.83 . . . . 0.0 110.506 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -57.61 -36.5 71.85 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 123.06 0.544 . . . . 0.0 111.756 173.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -68.15 -38.07 81.74 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.75 0.82 . . . . 0.0 111.438 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 59.4 mt -68.46 -46.56 69.44 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -56.97 -35.2 68.87 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.277 1.031 . . . . 0.0 112.83 173.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -63.22 -45.18 92.82 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 119.36 0.982 . . . . 0.0 110.064 176.385 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 83.6 mt -62.73 -37.62 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 C-N-CA 123.955 0.902 . . . . 0.0 109.936 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' ILE . . . . . 0.458 HD11 HD22 ' A' ' 81' ' ' LEU . 25.0 mm -60.39 -49.01 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 118.412 0.551 . . . . 0.0 110.409 170.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 44.2 m -66.16 -24.96 66.74 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -168.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -65.31 -33.52 76.17 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.85 0.75 . . . . 0.0 111.118 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.132 0 CA-C-O 117.52 -1.711 . . . . 0.0 109.197 -169.398 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.0 ttm . . . . . 0 N--CA 1.487 1.396 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -64.17 114.27 4.09 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -54.35 -43.73 71.55 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.141 1.376 . . . . 0.0 109.457 -178.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.8 -18.43 8.52 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.246 1.418 . . . . 0.0 113.183 -177.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -66.99 -31.12 71.46 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.449 1.022 . . . . 0.0 111.648 176.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -87.86 -30.65 20.0 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.508 -0.758 . . . . 0.0 112.346 -173.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -91.13 109.81 37.97 Favored Pre-proline 0 CA--C 1.543 0.706 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -176.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.3 -83.55 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.835 2.357 . . . . 0.0 112.625 -169.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -157.39 163.21 38.82 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 127.257 2.223 . . . . 0.0 106.113 172.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 57.58 5.06 0.28 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.771 1.628 . . . . 0.0 113.125 -175.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.4 p -81.98 1.28 36.21 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.734 2.814 . . . . 0.0 113.393 -168.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.4 mt -131.61 123.26 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -169.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.0 m -142.6 146.42 34.54 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 123.413 0.446 . . . . 0.0 111.488 -176.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -118.81 141.25 39.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 105.496 -2.039 . . . . 0.0 105.496 169.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.3 mt -140.69 148.23 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 C-N-CA 125.714 1.606 . . . . 0.0 107.441 -169.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -69.37 -52.62 25.36 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 172.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 t -162.03 163.56 28.72 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 169.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.93 158.45 21.57 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.92 -0.771 . . . . 0.0 108.92 173.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -59.07 -43.43 91.75 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.419 174.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -164.53 177.41 8.14 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 128.031 2.532 . . . . 0.0 107.555 173.057 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -55.52 -37.88 68.49 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.028 1.731 . . . . 0.0 113.819 176.033 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.409 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.9 mt-30 -62.64 -49.71 74.09 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 120.158 1.345 . . . . 0.0 108.489 173.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -60.41 -33.28 72.28 Favored 'General case' 0 C--O 1.223 -0.314 0 O-C-N 121.906 -0.496 . . . . 0.0 111.707 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.32 -37.3 86.67 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.645 -0.66 . . . . 0.0 110.637 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.97 -47.14 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 170.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -58.87 -48.97 79.51 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 123.266 0.626 . . . . 0.0 110.374 -174.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -60.81 -31.32 70.72 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.508 1.123 . . . . 0.0 111.4 173.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.9 m -82.66 -9.02 59.56 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 119.566 1.075 . . . . 0.0 113.676 179.214 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 14.2 mmt -121.26 -20.93 6.54 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.12 0.873 . . . . 0.0 112.821 -176.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.8 p -57.47 -34.03 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 120.352 1.433 . . . . 0.0 111.982 -173.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.0 m -65.07 -29.43 70.31 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.211 0.914 . . . . 0.0 111.902 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.2 mt -79.5 -42.47 25.15 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.092 0.957 . . . . 0.0 108.737 173.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.6 -44.01 85.11 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.921 0.888 . . . . 0.0 110.763 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.6 -28.76 67.46 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 126.651 1.98 . . . . 0.0 113.136 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -111.4 21.06 16.65 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.292 0.7 OUTLIER 47.99 33.44 3.44 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.132 1.773 . . . . 0.0 114.67 -178.953 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -67.86 -22.18 65.13 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.865 -1.147 . . . . 0.0 111.318 169.458 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.1 pt -145.37 172.59 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 C-N-CA 126.26 1.824 . . . . 0.0 108.235 -174.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 m -108.98 161.04 15.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.618 1.567 . . . . 0.0 108.366 172.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.57 -32.54 72.64 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.863 -1.148 . . . . 0.0 111.464 -178.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -59.01 -36.31 74.71 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.771 -0.581 . . . . 0.0 111.877 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -58.73 -48.24 81.84 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 123.386 0.674 . . . . 0.0 109.487 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 28.8 mt -57.97 -49.91 79.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 124.336 1.054 . . . . 0.0 108.923 178.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -68.19 -26.96 66.0 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.06 -0.971 . . . . 0.0 111.831 -175.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.24 -40.1 89.06 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.812 1.187 . . . . 0.0 110.815 172.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.7 mt -67.97 -51.91 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.409 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.0 mttt -58.9 -43.84 91.08 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -175.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -63.76 -45.76 88.35 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.465 1.106 . . . . 0.0 111.124 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 27.7 m -63.22 -38.2 90.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.402 0.546 . . . . 0.0 110.794 177.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 88.0 m . . . . . 0 N--CA 1.45 -0.44 0 C-N-CA 124.136 0.974 . . . . 0.0 109.578 177.404 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 C--O 1.235 0.303 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.7 mm -131.22 134.33 61.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 102.179 -3.267 . . . . 0.0 102.179 172.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -116.92 -28.92 6.15 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -168.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -165.73 163.67 12.42 Favored Pre-proline 0 C--O 1.237 0.437 0 C-N-CA 125.311 1.444 . . . . 0.0 107.536 -177.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -46.52 116.88 1.76 Allowed 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 123.027 2.485 . . . . 0.0 110.993 169.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.8 0.93 83.28 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.47 -1.739 . . . . 0.0 114.888 175.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.2 t -127.83 126.59 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 120.232 2.016 . . . . 0.0 109.605 -170.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.15 164.58 22.17 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 125.595 1.558 . . . . 0.0 110.06 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 tmm? -149.05 76.95 9.35 Favored Pre-proline 0 C--O 1.223 -0.313 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -59.04 -89.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 122.849 2.366 . . . . 0.0 114.985 -169.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . 0.254 0.0 OUTLIER 51.26 177.15 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.025 2.13 . . . . 0.0 113.943 -169.176 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.53 159.88 40.21 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 125.307 1.443 . . . . 0.0 108.568 177.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -62.53 147.78 91.75 Favored Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.09 177.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -44.58 -44.42 13.76 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 124.479 3.452 . . . . 0.0 114.032 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.42 -12.04 12.86 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.286 1.435 . . . . 0.0 113.843 -176.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 60.0 m -79.28 -4.15 49.38 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.615 0.643 . . . . 0.0 111.62 179.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 127.36 19.2 1.93 Allowed Glycine 0 C--N 1.337 0.622 0 CA-C-O 118.539 -1.145 . . . . 0.0 113.249 175.079 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.49 149.32 50.23 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 119.206 1.503 . . . . 0.0 109.075 169.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -130.78 -31.52 1.74 Allowed 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.375 1.07 . . . . 0.0 110.661 -174.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -146.18 157.35 43.82 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.011 1.324 . . . . 0.0 108.951 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.427 ' HA ' ' O ' ' A' ' 104' ' ' SER . 89.7 m -90.31 126.15 35.76 Favored 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 123.041 0.536 . . . . 0.0 110.203 -177.653 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -168.98 -174.52 37.62 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 125.482 1.515 . . . . 0.0 111.252 -175.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 40.8 mtt -151.42 170.06 20.5 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.103 1.761 . . . . 0.0 111.064 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 36.6 m -153.41 169.65 22.63 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.56 1.544 . . . . 0.0 109.931 171.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 18.1 tp -142.91 130.18 20.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 127.145 2.178 . . . . 0.0 109.561 -169.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.475 ' O ' HD22 ' A' ' 99' ' ' LEU . 35.7 m -136.52 133.86 36.93 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -176.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 17.3 tp -125.38 134.51 52.14 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 171.056 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.5 mp -110.63 133.52 53.25 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 173.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -67.6 -43.87 79.46 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 118.308 0.504 . . . . 0.0 110.676 176.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -84.54 -24.73 29.17 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.806 0.842 . . . . 0.0 112.271 -177.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 71.69 165.54 7.27 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -168.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -135.2 163.47 35.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 169.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -120.55 93.36 4.02 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.867 0.841 . . . . 0.0 111.422 -168.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 . . . . . 0 CA--C 1.538 0.508 0 CA-C-N 114.66 -1.154 . . . . 0.0 112.221 171.015 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo . . . . . 0 N--CA 1.457 -0.647 0 CA-C-O 121.035 0.348 . . . . 0.0 112.93 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.6 mm -115.81 128.23 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 174.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -94.43 -34.01 12.9 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.458 -1.258 . . . . 0.0 109.858 169.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.475 HD22 ' O ' ' A' ' 82' ' ' THR . 3.1 tm? -119.51 131.15 55.5 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 120.333 1.424 . . . . 0.0 110.17 -169.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mp -129.37 135.4 48.67 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -111.32 132.16 60.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 168.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -103.38 157.46 17.66 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.478 HD23 ' N ' ' A' ' 104' ' ' SER . 0.7 OUTLIER -146.95 154.59 41.44 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 -179.827 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.478 ' N ' HD23 ' A' ' 103' ' ' LEU . 88.3 p -142.85 146.15 33.85 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 104.63 -2.359 . . . . 0.0 104.63 168.324 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.23 129.43 12.77 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 119.535 1.061 . . . . 0.0 108.987 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -74.57 -18.92 60.5 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.819 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -141.86 151.97 43.2 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 123.715 0.806 . . . . 0.0 110.328 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.65 -33.66 73.13 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -175.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -78.21 -31.06 49.21 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 119.313 0.96 . . . . 0.0 111.061 177.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.0 m -62.81 -39.4 94.18 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 169.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.91 -48.34 80.17 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.387 1.075 . . . . 0.0 110.483 171.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.5 mm -58.71 -51.89 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.49 -38.8 95.43 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 118.912 0.778 . . . . 0.0 111.651 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.8 -53.5 39.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.306 1.042 . . . . 0.0 110.394 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.4 mm -51.17 -48.16 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.663 1.585 . . . . 0.0 108.56 176.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -68.27 -16.09 63.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.425 0.69 . . . . 0.0 112.006 -176.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -87.5 -44.83 11.0 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.631 0.773 . . . . 0.0 109.613 172.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.403 HD21 HD12 ' A' ' 103' ' ' LEU . 3.8 pp -68.78 -25.77 64.87 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 118.662 0.664 . . . . 0.0 111.316 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 49.1 m -60.79 -21.88 63.53 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 123.759 0.823 . . . . 0.0 112.32 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -66.5 -17.68 64.94 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.307 0.958 . . . . 0.0 110.299 173.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 36.1 mt -105.95 -58.69 1.88 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.382 1.473 . . . . 0.0 109.898 177.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.8 -28.13 65.7 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 114.433 1.272 . . . . 0.0 114.433 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 42.0 m -108.52 26.73 10.15 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.912 0.778 . . . . 0.0 110.844 -175.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -132.42 97.51 4.12 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 124.679 1.192 . . . . 0.0 108.054 178.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.54 -27.46 49.06 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.841 0.856 . . . . 0.0 112.526 -177.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.13 -44.83 87.42 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.104 0.562 . . . . 0.0 110.013 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.62 -44.98 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 174.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.8 mt -53.74 -45.73 70.62 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 118.429 0.559 . . . . 0.0 111.555 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -65.78 -38.55 89.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.435 0.561 . . . . 0.0 110.705 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.401 ' HB3' HD11 ' A' ' 143' ' ' ILE . 45.1 mt-30 -70.1 -32.45 70.51 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 118.64 0.654 . . . . 0.0 110.11 -177.058 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 25.6 mt -68.75 -52.97 24.82 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 55.1 mt -59.17 -13.12 6.37 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -176.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 81.4 p -123.84 10.87 8.97 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.223 1.409 . . . . 0.0 110.898 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.01 119.02 5.58 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 124.624 1.17 . . . . 0.0 109.879 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.5 p -71.95 -16.17 62.09 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.321 1.048 . . . . 0.0 112.307 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 73.4 p -159.38 164.87 34.31 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.571 0.623 . . . . 0.0 111.067 -172.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.27 -33.81 75.35 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 169.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -60.36 -37.47 80.8 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 121.827 -0.545 . . . . 0.0 111.573 174.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -77.28 -28.54 53.43 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 119.703 1.138 . . . . 0.0 110.713 179.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 35.2 mt -65.44 -48.63 72.09 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 120.286 1.403 . . . . 0.0 108.289 169.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.04 -34.1 69.71 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.821 1.248 . . . . 0.0 113.189 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -63.17 -42.01 99.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 119.066 0.848 . . . . 0.0 110.487 176.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.401 HD11 ' HB3' ' A' ' 130' ' ' GLN . 91.4 mt -68.47 -36.54 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 123.343 0.657 . . . . 0.0 109.527 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.3 mm -57.85 -52.64 55.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 169.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 28.8 m -64.11 -28.02 69.49 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 122.816 0.446 . . . . 0.0 111.484 -170.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -59.64 -28.5 67.28 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.675 1.59 . . . . 0.0 113.396 175.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.911 0 N-CA-C 108.904 -1.679 . . . . 0.0 108.904 -174.452 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 tpt . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -65.98 110.0 2.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 168.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.51 -45.99 66.46 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.683 0.793 . . . . 0.0 109.746 -175.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.47 -19.93 6.66 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.279 1.832 . . . . 0.0 113.143 -176.382 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.4 -31.47 72.15 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 119.349 0.977 . . . . 0.0 111.995 175.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -88.3 -22.38 23.92 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.686 -174.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -99.4 100.14 9.9 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 -173.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.18 -81.13 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 123.689 2.926 . . . . 0.0 113.298 -169.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -157.05 161.03 39.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.43 2.292 . . . . 0.0 105.485 172.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 m 59.06 -0.12 0.15 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.568 1.547 . . . . 0.0 113.075 -174.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.1 p -80.05 4.65 16.43 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 128.397 2.679 . . . . 0.0 112.708 -169.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 6.6 mt -133.32 132.04 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 N-CA-C 104.145 -2.539 . . . . 0.0 104.145 -173.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.0 m -156.15 147.4 22.44 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 118.685 0.675 . . . . 0.0 111.066 -179.076 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 85.3 t -116.67 143.45 26.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 169.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mt -138.7 147.51 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 C-N-CA 126.245 1.818 . . . . 0.0 106.31 -172.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -72.47 -47.51 48.18 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.594 -0.691 . . . . 0.0 109.713 172.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.2 p -160.67 141.91 12.0 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.073 -1.455 . . . . 0.0 107.073 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.82 155.1 35.71 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -56.34 -44.83 80.42 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.631 0.772 . . . . 0.0 109.716 177.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -163.58 -176.92 4.93 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.824 2.05 . . . . 0.0 108.242 170.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -64.3 -32.79 74.52 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.485 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 35.0 mt-30 -58.88 -50.52 73.69 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.805 1.639 . . . . 0.0 107.206 171.188 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -60.73 -35.22 75.8 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 121.795 -0.566 . . . . 0.0 111.806 177.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.97 -31.94 72.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 121.894 -0.504 . . . . 0.0 110.905 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.25 -48.53 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 170.06 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -55.96 -45.63 78.84 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 118.23 0.468 . . . . 0.0 110.442 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -64.69 -28.91 69.92 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 118.031 -0.985 . . . . 0.0 112.343 174.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.9 m -69.9 -19.95 63.39 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.223 1.374 . . . . 0.0 112.224 172.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.2 mmt -123.86 -18.68 5.93 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -168.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.2 p -57.03 -37.88 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 120.273 1.397 . . . . 0.0 112.591 -169.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.3 m -67.21 -27.7 67.46 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.825 0.738 . . . . 0.0 111.568 -178.586 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.4 mt -77.43 -44.37 29.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.649 0.78 . . . . 0.0 108.986 172.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -56.4 -51.02 69.91 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.109 0.964 . . . . 0.0 110.092 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -56.21 -28.59 58.85 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 126.576 1.95 . . . . 0.0 113.757 -176.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -113.71 24.45 12.12 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 123.057 0.543 . . . . 0.0 109.996 -175.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 61.66 20.69 11.54 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 171.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -71.24 -24.18 62.14 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.894 -1.129 . . . . 0.0 111.158 174.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.4 pt -143.88 176.3 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.101 1.76 . . . . 0.0 108.929 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m -114.26 160.56 18.9 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.597 1.959 . . . . 0.0 108.203 175.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -59.02 -37.47 76.98 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.907 1.231 . . . . 0.0 111.826 -175.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -60.71 -22.54 64.07 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.797 0.839 . . . . 0.0 113.206 175.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -65.25 -45.58 83.98 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.798 1.181 . . . . 0.0 109.934 174.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.99 -50.53 79.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -69.86 -23.86 63.34 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.952 -173.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.01 -42.7 90.74 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 120.149 1.341 . . . . 0.0 111.025 172.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.5 mt -70.09 -46.3 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.5 mttt -61.64 -40.62 95.55 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -65.13 -38.55 91.01 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 124.176 0.99 . . . . 0.0 111.445 178.1 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.9 m -61.72 -42.05 98.43 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.733 -0.604 . . . . 0.0 109.603 171.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 22.6 m . . . . . 0 CA--C 1.545 0.756 0 O-C-N 121.463 -0.773 . . . . 0.0 110.915 177.895 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.6 mm -124.91 136.02 62.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -121.97 -31.26 3.94 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 123.651 0.78 . . . . 0.0 110.923 -172.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.77 160.21 30.16 Favored Pre-proline 0 CA--C 1.534 0.351 0 C-N-CA 125.883 1.673 . . . . 0.0 106.708 173.577 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -49.84 119.91 5.36 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.394 2.063 . . . . 0.0 109.979 169.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.9 -6.2 73.07 Favored Glycine 0 CA--C 1.532 1.104 0 CA-C-O 117.843 -1.532 . . . . 0.0 114.465 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.6 t -126.25 117.35 48.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 119.769 1.785 . . . . 0.0 108.339 -170.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -118.76 168.8 10.4 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.412 1.085 . . . . 0.0 110.246 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.528 ' CE ' HD11 ' A' ' 118' ' ' LEU . 7.2 ttm -140.69 62.31 17.72 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 122.93 0.492 . . . . 0.0 111.99 177.003 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.59 135.64 48.54 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 121.56 1.506 . . . . 0.0 111.83 -179.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 176.42 157.61 0.27 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 128.28 2.632 . . . . 0.0 106.221 -170.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.13 163.92 30.46 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.207 1.403 . . . . 0.0 108.224 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -58.11 153.91 32.89 Favored Pre-proline 0 N--CA 1.465 0.312 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.104 175.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.3 -39.21 91.56 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 122.13 1.886 . . . . 0.0 110.446 -172.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -61.86 -15.31 41.27 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.704 1.602 . . . . 0.0 113.055 -178.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 83.7 m -79.11 -8.61 59.12 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.656 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 139.02 13.5 0.69 Allowed Glycine 0 C--N 1.339 0.736 0 CA-C-O 117.825 -1.542 . . . . 0.0 114.206 173.812 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.29 147.49 52.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.854 1.827 . . . . 0.0 109.625 173.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.1 mt -130.6 -35.55 1.48 Allowed 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.309 1.043 . . . . 0.0 110.32 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -148.6 158.34 44.06 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.292 1.437 . . . . 0.0 108.542 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 83.4 m -90.29 133.74 34.75 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 122.988 0.515 . . . . 0.0 111.927 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -177.34 -179.14 47.49 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.923 1.249 . . . . 0.0 111.11 -177.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 24.2 mtm -146.65 169.67 18.53 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 126.241 1.816 . . . . 0.0 110.775 -179.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.0 m -151.04 170.61 18.96 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.473 1.509 . . . . 0.0 109.425 171.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.418 HD22 HD11 ' A' ' 144' ' ' ILE . 28.9 tp -145.78 131.02 18.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 127.854 2.461 . . . . 0.0 108.408 -169.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 28.6 m -140.78 137.19 33.18 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -173.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -129.27 141.44 51.11 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 172.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.7 mp -119.61 126.83 52.12 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 126.398 1.879 . . . . 0.0 106.368 176.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.42 -44.73 90.32 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.423 0.556 . . . . 0.0 111.251 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 38.1 mm-40 -85.53 -23.54 27.65 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 124.292 1.037 . . . . 0.0 111.667 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 73.97 176.18 33.75 Favored Glycine 0 CA--C 1.532 1.145 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -168.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.93 160.27 13.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 169.317 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -109.76 101.61 10.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.67 0.748 . . . . 0.0 110.543 -168.798 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 . . . . . 0 CA--C 1.541 0.633 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.448 169.887 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo . . . . . 0 N--CA 1.46 -0.498 0 N-CA-C 113.407 0.503 . . . . 0.0 113.407 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 22.9 mm -84.93 136.32 23.01 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.291 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 172.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -111.59 -18.46 12.8 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 117.686 -1.149 . . . . 0.0 110.625 170.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 131' ' ' LEU . 15.3 tp -140.4 135.56 32.21 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 120.001 1.273 . . . . 0.0 109.818 -173.044 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.3 mp -138.6 138.37 37.84 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 -174.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.1 mt -115.24 128.93 72.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 168.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.28 149.95 21.66 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 108.592 -1.803 . . . . 0.0 108.592 170.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 104' ' ' SER . 0.5 OUTLIER -148.6 144.82 27.48 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 172.846 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.541 ' N ' HD23 ' A' ' 103' ' ' LEU . 77.9 p -142.48 145.95 34.25 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 168.299 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.474 ' HB3' ' CG ' ' A' ' 111' ' ' HIS . . . -145.96 145.85 30.81 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 118.553 0.615 . . . . 0.0 109.706 171.19 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.89 -16.94 59.96 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.477 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -137.61 155.8 48.78 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.362 0.665 . . . . 0.0 110.746 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.37 -38.62 90.27 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.342 0.657 . . . . 0.0 112.472 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -73.05 -31.1 64.2 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.211 -0.93 . . . . 0.0 110.837 178.476 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.3 m -64.36 -37.99 89.44 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.289 169.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.474 ' CG ' ' HB3' ' A' ' 105' ' ' ALA . 24.0 m80 -62.23 -44.64 96.1 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.779 171.134 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.6 -51.28 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-N 119.141 0.882 . . . . 0.0 108.874 177.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.59 -40.72 96.74 Favored Glycine 0 CA--C 1.531 1.063 0 CA-C-N 119.063 0.847 . . . . 0.0 111.916 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.15 70.7 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.617 0.767 . . . . 0.0 111.096 -179.053 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 5.0 mm -58.91 -46.12 91.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 125.201 1.4 . . . . 0.0 108.168 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.1 mm-40 -69.02 -9.97 55.18 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.135 -0.978 . . . . 0.0 111.623 -178.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.41 -50.63 5.54 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.929 0.892 . . . . 0.0 108.93 172.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.528 HD11 ' CE ' ' A' ' 65' ' ' MET . 3.9 pp -68.52 -27.34 66.02 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.773 -0.579 . . . . 0.0 111.646 -176.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.4 m -62.42 -20.98 65.04 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.318 0.508 . . . . 0.0 112.062 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -64.16 -19.12 65.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.283 0.947 . . . . 0.0 110.096 171.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 33.4 mt -108.12 -60.54 1.71 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.022 1.729 . . . . 0.0 110.941 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.4 mt -65.75 -18.13 65.11 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -175.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.6 m -111.39 26.84 10.25 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.268 0.94 . . . . 0.0 110.887 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -139.54 97.47 3.28 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -172.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -55.83 -27.39 51.24 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.789 0.836 . . . . 0.0 112.418 -175.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -61.95 -45.08 95.22 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 122.875 0.47 . . . . 0.0 110.125 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.5 mp -71.69 -45.04 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 123.662 0.785 . . . . 0.0 108.887 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.0 mt -55.69 -41.67 74.06 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.026 -172.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -70.83 -33.98 71.22 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 118.435 0.561 . . . . 0.0 110.327 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -66.13 -41.65 90.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.222 0.919 . . . . 0.0 108.764 179.284 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.465 HD13 HD21 ' A' ' 99' ' ' LEU . 21.4 mt -69.02 -48.08 63.86 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 64.1 mt -62.66 -5.9 3.1 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 178.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 73.8 p -122.6 11.73 9.89 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.346 1.458 . . . . 0.0 110.923 175.033 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.17 110.09 2.07 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 124.378 1.071 . . . . 0.0 109.974 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -73.99 -14.71 61.07 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.782 0.833 . . . . 0.0 112.303 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 82.1 p -151.73 163.74 38.48 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 118.943 0.792 . . . . 0.0 110.866 -174.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.74 -39.67 74.4 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.523 1.129 . . . . 0.0 109.671 169.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -59.93 -40.01 87.47 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 123.27 0.628 . . . . 0.0 110.84 177.83 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -65.85 -38.76 89.73 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 118.865 0.757 . . . . 0.0 112.261 177.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.3 mt -62.79 -48.24 79.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.637 1.108 . . . . 0.0 108.517 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.74 -37.19 73.17 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.561 1.145 . . . . 0.0 113.66 174.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.83 -39.72 95.21 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 121.187 -0.946 . . . . 0.0 110.099 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 49.9 mt -71.93 -35.76 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 123.718 0.807 . . . . 0.0 110.206 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 144' ' ' ILE . . . . . 0.418 HD11 HD22 ' A' ' 81' ' ' LEU . 17.1 mm -57.01 -46.28 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 118.835 0.743 . . . . 0.0 109.776 169.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 43.8 m -65.02 -22.53 67.01 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -169.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ARG . . . . . 0.482 ' HG2' HH11 ' A' ' 146' ' ' ARG . 6.1 mtt-85 -68.11 -35.72 78.59 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.978 0.808 . . . . 0.0 111.509 176.595 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.154 0 CA-C-O 117.779 -1.567 . . . . 0.0 110.834 -168.764 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.759 0.314 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -65.44 115.18 5.42 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -53.67 -45.33 70.25 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.466 1.104 . . . . 0.0 108.457 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.42 -27.1 5.83 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 126.519 1.928 . . . . 0.0 113.34 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.52 -28.38 68.36 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.947 0.794 . . . . 0.0 112.539 178.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -93.09 -14.68 26.97 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.03 0.932 . . . . 0.0 113.085 -173.079 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -102.65 114.43 65.33 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 120.561 1.528 . . . . 0.0 108.589 -173.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.82 -76.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.436 2.757 . . . . 0.0 113.46 -176.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.401 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.7 tp10 -162.52 -68.84 0.05 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.432 1.093 . . . . 0.0 110.957 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -67.32 4.53 0.95 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.923 1.289 . . . . 0.0 112.077 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.401 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -70.51 -8.73 53.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.534 1.934 . . . . 0.0 113.056 -170.742 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.9 mt -120.52 125.5 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -169.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.6 m -145.27 149.58 35.11 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.321 0.581 . . . . 0.0 111.219 -175.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.5 t -126.25 138.49 54.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 170.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.1 mt -139.25 150.45 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 -174.601 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -70.19 -46.69 64.07 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.699 -0.625 . . . . 0.0 110.282 177.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.1 p -164.15 146.66 9.15 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.604 ' HB3' HG21 ' A' ' 88' ' ' VAL . . . -76.89 160.98 28.77 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.245 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -57.48 -43.39 84.04 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.07 0.548 . . . . 0.0 110.417 173.151 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -168.35 178.86 4.69 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 127.038 2.135 . . . . 0.0 108.342 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -61.81 -34.33 75.74 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.807 1.643 . . . . 0.0 113.045 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.436 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 53.9 mm-40 -62.03 -50.93 70.03 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.663 1.574 . . . . 0.0 107.834 169.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -60.25 -35.44 75.5 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 121.836 -0.54 . . . . 0.0 111.705 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.1 -31.89 73.14 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.555 0.742 . . . . 0.0 110.751 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -71.16 -46.71 64.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 173.286 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -56.93 -45.86 82.45 Favored 'General case' 0 C--O 1.226 -0.18 0 O-C-N 121.656 -0.653 . . . . 0.0 110.517 178.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -64.1 -30.33 71.41 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.375 -0.821 . . . . 0.0 111.894 174.612 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 m -67.45 -27.29 66.91 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.587 1.085 . . . . 0.0 112.173 173.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 2.2 mmm -119.79 -13.54 9.09 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.087 1.312 . . . . 0.0 114.425 -169.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.6 p -58.21 -39.13 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 120.792 1.633 . . . . 0.0 112.723 -169.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.0 m -66.11 -22.78 66.41 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.017 0.826 . . . . 0.0 111.908 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.7 mt -82.55 -43.05 17.58 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.061 0.944 . . . . 0.0 108.925 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.82 -49.96 71.83 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.094 0.958 . . . . 0.0 109.737 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.58 -30.6 61.13 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 126.212 1.805 . . . . 0.0 113.947 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.8 mttm -111.27 22.66 14.94 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.35 -175.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 57.74 25.42 11.83 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.463 -0.79 . . . . 0.0 113.054 173.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -69.12 -25.72 64.54 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.279 -0.888 . . . . 0.0 110.368 169.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.3 pt -144.47 176.54 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 125.759 1.623 . . . . 0.0 109.288 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.5 m -116.61 159.1 22.66 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.7 2.0 . . . . 0.0 108.04 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -58.56 -33.44 69.92 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.651 1.114 . . . . 0.0 113.22 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -57.02 -32.23 65.94 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.169 0.587 . . . . 0.0 111.775 175.105 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -60.23 -45.77 92.09 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.366 0.666 . . . . 0.0 110.421 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.31 -49.32 83.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -69.6 -24.54 63.68 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.219 -177.059 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.47 -44.42 94.46 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 120.084 1.311 . . . . 0.0 110.488 174.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 56.1 mt -67.04 -47.04 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.5 mttt -58.67 -43.91 90.05 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 117.89 0.314 . . . . 0.0 110.781 -178.075 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -67.41 -39.87 85.54 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 124.272 1.029 . . . . 0.0 110.934 -178.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.6 m -62.14 -40.59 96.45 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.281 0.562 . . . . 0.0 110.223 173.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.4 m . . . . . 0 CA--C 1.54 0.562 0 C-N-CA 124.01 0.924 . . . . 0.0 110.917 177.817 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 23.8 mm -141.19 139.13 33.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 mp -132.09 -25.8 1.98 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -170.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.13 161.43 25.85 Favored Pre-proline 0 C--O 1.237 0.401 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 176.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -49.63 116.38 2.31 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.487 2.125 . . . . 0.0 111.005 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.55 4.92 69.84 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.152 -1.36 . . . . 0.0 114.501 177.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.6 t -129.5 122.69 55.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-N 119.33 1.565 . . . . 0.0 108.81 -169.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -121.09 166.03 14.49 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.297 1.439 . . . . 0.0 110.122 177.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 24.7 ttm -136.41 63.88 50.22 Favored Pre-proline 0 CA--C 1.542 0.663 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.73 173.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.52 147.57 22.68 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.18 1.92 . . . . 0.0 113.865 -173.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 174.07 154.92 0.12 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.535 2.334 . . . . 0.0 107.329 -169.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.66 151.7 50.47 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 106.657 -1.609 . . . . 0.0 106.657 169.554 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -53.6 141.86 43.62 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-O 117.429 -1.272 . . . . 0.0 109.265 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -43.67 -44.46 11.24 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 124.24 3.293 . . . . 0.0 114.645 -170.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -63.73 -9.23 13.18 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.689 1.196 . . . . 0.0 114.023 -177.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 61.7 m -76.63 -1.66 28.8 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.128 0.971 . . . . 0.0 111.867 175.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 129.09 13.48 2.4 Favored Glycine 0 C--N 1.336 0.577 0 CA-C-O 118.185 -1.341 . . . . 0.0 112.985 172.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.4 148.26 52.02 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 119.342 1.571 . . . . 0.0 109.278 170.006 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 86.2 mt -133.04 -31.05 1.3 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 124.751 1.22 . . . . 0.0 110.975 -173.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -143.91 166.84 23.81 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 126.057 1.743 . . . . 0.0 107.042 178.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.2 m -101.93 125.91 48.71 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 123.17 0.588 . . . . 0.0 109.734 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -174.28 175.76 46.67 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.714 1.149 . . . . 0.0 111.276 -177.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.7 ' SD ' HD21 ' A' ' 118' ' ' LEU . 56.8 mtt -140.72 167.71 21.53 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.803 1.241 . . . . 0.0 112.246 -170.485 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 p -144.25 165.33 28.18 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.136 1.774 . . . . 0.0 109.377 178.105 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.489 HD22 HD11 ' A' ' 144' ' ' ILE . 34.0 tp -146.92 110.81 5.01 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.191 1.797 . . . . 0.0 107.861 -169.031 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 31.5 m -127.02 139.35 53.08 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -171.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 12.1 tp -135.22 145.35 47.56 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 174.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -125.01 112.35 16.46 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 126.161 1.785 . . . . 0.0 106.193 -173.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -59.83 -24.79 64.47 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -116.79 -5.32 11.56 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.192 0.997 . . . . 0.0 112.088 -177.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.95 168.58 4.43 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.628 1.109 . . . . 0.0 113.49 -173.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.604 HG21 ' HB3' ' A' ' 18' ' ' ALA . 16.3 t -139.11 148.99 23.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 105.137 -2.172 . . . . 0.0 105.137 174.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -116.42 100.62 8.0 Favored 'General case' 0 C--N 1.334 -0.093 0 O-C-N 121.762 -0.586 . . . . 0.0 110.712 -168.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 CA--C 1.539 0.53 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.679 173.838 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo . . . . . 0 N--CA 1.458 -0.603 0 N-CA-C 110.714 -0.533 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 40.7 mm -99.53 136.91 28.71 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 -177.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -109.72 -14.24 14.36 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 117.161 -1.4 . . . . 0.0 111.096 172.331 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.511 HD21 HD13 ' A' ' 131' ' ' LEU . 37.3 tp -144.11 131.9 21.36 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 120.603 1.547 . . . . 0.0 110.319 -169.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mp -138.71 117.2 12.07 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 -174.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.735 HG21 HD22 ' A' ' 118' ' ' LEU . 1.4 mp -98.39 111.02 27.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 105.141 -2.17 . . . . 0.0 105.141 173.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.07 151.39 36.91 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 174.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.436 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -143.26 142.93 31.53 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 105.408 -2.071 . . . . 0.0 105.408 172.05 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.436 ' N ' HD23 ' A' ' 103' ' ' LEU . 27.4 p -135.68 144.24 45.87 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 127.248 2.219 . . . . 0.0 106.498 169.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.8 135.94 22.57 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -175.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -77.98 -22.41 49.43 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.723 0.409 . . . . 0.0 111.803 -177.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -144.05 155.67 44.08 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.011 0.924 . . . . 0.0 110.019 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.09 -34.99 74.23 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -177.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -75.97 -32.11 59.33 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.865 -1.147 . . . . 0.0 110.937 177.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.9 m -62.51 -41.12 98.61 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 169.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 23.4 t60 -58.27 -49.93 75.4 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.027 0.931 . . . . 0.0 110.038 173.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.6 mm -55.94 -54.19 29.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 118.875 0.761 . . . . 0.0 109.568 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.06 -38.77 94.79 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.669 0.668 . . . . 0.0 111.702 -176.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.56 -48.49 60.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.466 1.107 . . . . 0.0 111.1 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.32 -43.55 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 124.489 1.115 . . . . 0.0 108.758 176.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -70.47 -11.11 60.71 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.716 0.806 . . . . 0.0 111.991 -178.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.88 -45.32 12.37 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 169.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.735 HD22 HG21 ' A' ' 101' ' ' ILE . 95.8 mt -71.13 -30.29 66.31 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.742 -0.599 . . . . 0.0 112.042 -173.668 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.1 m -61.44 -21.1 63.83 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 122.98 0.512 . . . . 0.0 112.076 172.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -68.7 -28.18 66.61 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.608 1.094 . . . . 0.0 110.0 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 40.0 mt -96.66 -63.6 1.12 Allowed 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.0 0.92 . . . . 0.0 111.037 -178.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.41 ' HA ' HD21 ' A' ' 128' ' ' LEU . 17.2 mt -73.38 -1.13 16.9 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -169.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 55.6 m -112.04 27.83 9.3 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.529 1.059 . . . . 0.0 111.357 174.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -141.33 97.66 3.21 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -171.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.87 -26.16 58.15 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.658 0.783 . . . . 0.0 112.371 -173.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -63.43 -46.3 86.95 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.224 0.535 . . . . 0.0 109.79 176.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.54 -43.79 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 C-N-CA 124.427 1.091 . . . . 0.0 109.134 176.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 122' ' ' LEU . 46.8 mt -56.52 -44.58 80.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 118.945 -0.55 . . . . 0.0 110.976 -173.047 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -67.04 -38.54 86.07 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 118.152 0.433 . . . . 0.0 110.367 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.402 ' HB3' HD11 ' A' ' 143' ' ' ILE . 49.2 mt-30 -67.64 -35.86 79.69 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 118.723 0.692 . . . . 0.0 109.696 -177.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.511 HD13 HD21 ' A' ' 99' ' ' LEU . 26.2 mt -70.06 -51.98 27.62 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 173.369 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 57.4 mt -60.54 -12.03 8.75 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 80.7 p -120.39 8.09 10.75 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.844 1.258 . . . . 0.0 111.321 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.49 114.67 3.08 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.591 1.156 . . . . 0.0 109.782 177.154 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.8 m -75.5 -20.26 58.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.857 0.863 . . . . 0.0 111.865 178.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.3 m -147.79 157.55 43.59 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.976 0.91 . . . . 0.0 109.939 -169.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -61.01 -38.62 86.72 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.434 1.093 . . . . 0.0 110.522 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -58.61 -36.63 74.32 Favored 'General case' 0 C--O 1.226 -0.178 0 O-C-N 121.946 -0.471 . . . . 0.0 111.389 175.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -68.87 -34.14 74.94 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 123.727 0.811 . . . . 0.0 112.074 177.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' LEU . . . . . 0.425 ' HB3' HD21 ' A' ' 81' ' ' LEU . 58.6 mt -67.28 -45.46 76.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.733 1.151 . . . . 0.0 107.954 172.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -64.65 -27.08 68.68 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -61.55 -38.84 88.94 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 120.776 -1.203 . . . . 0.0 109.914 174.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.402 HD11 ' HB3' ' A' ' 130' ' ' GLN . 80.1 mt -72.37 -34.99 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 124.514 1.125 . . . . 0.0 109.221 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' ILE . . . . . 0.489 HD11 HD22 ' A' ' 81' ' ' LEU . 36.3 mm -56.45 -51.76 60.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 169.172 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.6 m -65.57 -29.59 70.22 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.987 -170.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -61.51 -30.15 70.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.495 1.918 . . . . 0.0 112.569 172.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.006 0 CA-C-O 117.931 -1.483 . . . . 0.0 110.435 -172.357 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 ttt . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.14 112.78 1.3 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.889 0.376 . . . . 0.0 111.792 171.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.2 -34.38 68.46 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 123.359 0.664 . . . . 0.0 109.876 169.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -59.9 -12.29 7.37 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.189 1.396 . . . . 0.0 113.166 176.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -87.09 -32.22 20.05 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.618 1.099 . . . . 0.0 112.957 171.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -86.35 -43.81 12.58 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 122.794 0.438 . . . . 0.0 110.413 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.425 ' CD1' HG21 ' A' ' 144' ' ' ILE . 0.0 OUTLIER -86.66 119.25 71.2 Favored Pre-proline 0 CA--C 1.551 1.013 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 -178.06 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -82.66 -97.72 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.866 3.044 . . . . 0.0 112.225 -169.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -151.66 163.27 39.48 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.836 2.054 . . . . 0.0 106.756 173.043 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m 57.37 14.51 2.21 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.7 1.6 . . . . 0.0 112.226 -169.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.2 p -103.27 19.99 18.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.535 2.334 . . . . 0.0 112.354 -168.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.8 mt -133.74 141.35 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 169.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.8 m -156.93 149.45 23.34 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 169.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.7 t -113.48 133.56 59.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 103.793 -2.669 . . . . 0.0 103.793 169.57 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.2 mt -131.67 147.68 32.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -169.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -67.81 -44.64 76.82 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.814 -0.554 . . . . 0.0 110.604 177.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.7 m -165.47 148.55 7.95 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 -176.136 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.71 148.56 34.88 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 171.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.34 -37.48 83.47 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.109 0.564 . . . . 0.0 110.703 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -164.05 -179.21 6.06 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 127.078 2.151 . . . . 0.0 106.805 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 39.4 p-90 -66.48 -33.81 76.52 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 121.584 -0.698 . . . . 0.0 111.812 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.468 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 49.2 mt-30 -54.52 -51.08 66.29 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 169.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.37 -31.78 72.77 Favored 'General case' 0 C--O 1.222 -0.382 0 O-C-N 121.842 -0.536 . . . . 0.0 111.411 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.8 87.55 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 121.853 -0.529 . . . . 0.0 109.812 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.4 -45.68 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -57.92 -45.59 86.31 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.981 0.512 . . . . 0.0 110.423 -174.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -66.68 -32.26 73.46 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.778 -1.106 . . . . 0.0 111.815 173.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.3 m -61.42 -24.89 66.84 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 120.023 1.283 . . . . 0.0 111.675 173.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 9.3 mmt -120.13 -19.81 7.62 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -169.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.8 p -61.03 -34.15 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 CA-C-N 121.571 1.987 . . . . 0.0 112.212 -171.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.4 m -64.78 -30.11 71.11 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.245 0.929 . . . . 0.0 111.354 178.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.2 mt -74.57 -44.26 51.74 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.97 0.908 . . . . 0.0 108.584 172.104 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.4 tp -56.76 -40.17 75.34 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.881 0.872 . . . . 0.0 110.96 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -66.64 -30.59 70.89 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.116 1.367 . . . . 0.0 113.049 -173.034 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -98.81 14.71 27.86 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.001 0.364 . . . . 0.0 110.764 172.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.454 0.0 OUTLIER 44.9 43.62 7.22 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.183 2.193 . . . . 0.0 115.357 -169.636 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.478 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 30.6 m-85 -66.44 -19.75 65.88 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.509 -0.745 . . . . 0.0 109.489 168.05 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.1 pt -143.91 171.2 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 127.152 2.181 . . . . 0.0 108.585 -176.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.0 m -103.78 159.22 15.82 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.065 1.746 . . . . 0.0 107.52 169.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -59.87 -32.44 70.71 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.113 -0.992 . . . . 0.0 111.623 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -57.51 -34.96 69.65 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.12 0.568 . . . . 0.0 112.0 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -59.78 -40.84 89.61 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.72 0.808 . . . . 0.0 110.643 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.408 HG22 ' HE3' ' A' ' 47' ' ' LYS . 13.2 mt -63.73 -49.88 80.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.426 1.09 . . . . 0.0 108.599 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -66.14 -28.5 68.84 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 118.59 -0.719 . . . . 0.0 112.479 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.19 -43.16 78.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 118.82 0.736 . . . . 0.0 110.684 173.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 52.2 mt -69.26 -47.16 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.468 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.6 mttt -62.43 -43.87 97.78 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.373 0.533 . . . . 0.0 111.051 -173.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -66.61 -40.85 89.03 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.237 1.015 . . . . 0.0 110.757 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 18.3 m -63.98 -34.5 78.12 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.938 -0.476 . . . . 0.0 110.415 174.208 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 92.3 m . . . . . 0 CA--C 1.537 0.446 0 C-N-CA 123.752 0.821 . . . . 0.0 110.805 175.844 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 . . . . . 0 N--CA 1.462 0.169 0 CA-C-O 119.853 -0.118 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.1 mm -127.13 137.29 58.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 172.325 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -121.54 -31.17 4.08 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.309 0.644 . . . . 0.0 111.55 -170.044 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.56 160.1 27.95 Favored Pre-proline 0 C--O 1.236 0.343 0 C-N-CA 125.443 1.497 . . . . 0.0 107.046 176.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -50.92 113.31 1.03 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.53 2.153 . . . . 0.0 109.66 169.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 101.52 -6.19 55.2 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-O 117.528 -1.707 . . . . 0.0 114.538 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.4 t -130.45 127.49 62.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 120.036 1.918 . . . . 0.0 110.051 -169.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.62 166.33 16.91 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 126.214 1.805 . . . . 0.0 109.899 176.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.405 ' CE ' HD11 ' A' ' 118' ' ' LEU . 2.0 ttm -140.53 60.33 13.64 Favored Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 176.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 141.0 59.21 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.824 1.683 . . . . 0.0 113.755 -171.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -177.02 153.88 1.03 Allowed 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 128.537 2.735 . . . . 0.0 106.176 -170.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.82 160.52 38.3 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 126.41 1.884 . . . . 0.0 107.46 172.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.3 mtm105 -55.32 143.89 53.92 Favored Pre-proline 0 CA--C 1.535 0.398 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.838 177.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -45.94 -41.36 20.56 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.721 2.947 . . . . 0.0 113.335 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -61.77 -13.53 24.39 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.052 1.341 . . . . 0.0 113.288 -176.259 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 62.6 m -76.3 -3.99 39.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.463 0.705 . . . . 0.0 111.785 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.92 18.19 2.16 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.236 -1.313 . . . . 0.0 112.941 175.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.55 147.1 53.97 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 119.529 1.665 . . . . 0.0 109.107 169.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.4 mt -129.71 -29.74 2.12 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.356 1.062 . . . . 0.0 111.045 -173.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.478 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 87.9 mttt -143.58 157.78 44.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 125.707 1.603 . . . . 0.0 107.739 175.431 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.7 m -88.84 126.09 35.21 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.79 -178.4 39.79 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.019 0.819 . . . . 0.0 111.793 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 50.2 mtp -143.77 169.22 18.18 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 125.37 1.468 . . . . 0.0 111.132 -176.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.1 m -155.61 162.96 40.53 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.861 1.264 . . . . 0.0 109.444 169.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 mp -124.92 136.45 53.78 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 128.108 2.563 . . . . 0.0 107.141 -177.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 88.0 m -134.28 136.29 43.45 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 175.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.2 tp -129.06 144.59 51.24 Favored 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 123.346 0.404 . . . . 0.0 110.248 171.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -114.24 143.48 44.77 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.139 1.375 . . . . 0.0 109.735 174.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -74.95 -33.31 61.92 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 168.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -125.43 94.91 4.28 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.567 1.947 . . . . 0.0 107.324 174.105 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -56.81 162.35 7.06 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.188 0.899 . . . . 0.0 112.589 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 92.7 t -130.78 145.99 34.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 -173.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -105.21 172.27 6.88 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.733 0.813 . . . . 0.0 109.374 -174.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 CA--C 1.535 0.379 0 C-N-CA 124.718 1.207 . . . . 0.0 113.202 -169.385 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo . . . . . 0 N--CA 1.449 -1.137 0 N-CA-C 110.58 -0.584 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 39.9 mm -105.36 123.85 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -91.08 -22.63 20.63 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.291 -1.337 . . . . 0.0 111.043 170.398 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 40.7 tp -132.07 128.7 38.77 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.293 1.406 . . . . 0.0 110.649 -169.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.4 mp -132.02 138.05 48.07 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -178.261 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 6.0 mt -123.43 107.53 19.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -71.23 147.99 43.47 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 174.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.414 HD12 HD21 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -144.57 135.45 24.93 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 169.75 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.9 p -129.4 148.28 51.3 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 125.751 1.62 . . . . 0.0 106.793 168.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.84 133.24 21.85 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 118.88 0.764 . . . . 0.0 109.568 -177.065 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.71 -20.09 61.28 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.892 0.477 . . . . 0.0 111.878 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -147.58 152.62 38.25 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.381 1.072 . . . . 0.0 109.364 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.86 -32.87 71.09 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -175.596 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -77.9 -30.45 50.7 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 119.416 1.007 . . . . 0.0 111.32 178.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 7.9 m -64.76 -37.17 86.7 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.739 -0.6 . . . . 0.0 109.983 169.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -47.07 86.55 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 124.063 0.945 . . . . 0.0 110.185 170.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.5 mm -58.37 -49.45 81.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -57.39 -41.68 93.31 Favored Glycine 0 CA--C 1.532 1.103 0 CA-C-N 118.97 0.805 . . . . 0.0 111.924 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.28 -45.67 65.86 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.524 0.73 . . . . 0.0 111.213 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.0 mm -55.08 -46.71 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 124.86 1.264 . . . . 0.0 108.02 174.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -68.41 -9.87 51.35 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.422 1.089 . . . . 0.0 112.348 -177.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -95.95 -43.22 7.91 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 124.593 1.157 . . . . 0.0 110.834 171.248 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.414 HD21 HD12 ' A' ' 103' ' ' LEU . 4.4 pp -76.05 -26.62 56.73 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 118.376 0.534 . . . . 0.0 111.407 -175.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.6 p -59.4 -21.98 60.73 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.089 173.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -65.61 -20.4 66.3 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.137 0.881 . . . . 0.0 110.182 172.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 23.1 mt -102.2 -60.86 1.47 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.319 1.447 . . . . 0.0 111.037 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.79 -31.9 68.83 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.986 1.314 . . . . 0.0 113.802 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 59.6 m -104.58 26.74 8.67 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 118.641 0.655 . . . . 0.0 110.74 -174.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -132.29 97.9 4.25 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.0 -28.11 55.77 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.572 0.749 . . . . 0.0 112.263 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -65.61 -44.02 87.85 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.07 0.548 . . . . 0.0 110.142 176.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.64 -42.54 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 123.595 0.758 . . . . 0.0 108.998 175.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 62.2 mt -55.24 -43.87 74.98 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-O 118.711 -0.662 . . . . 0.0 110.595 -177.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -65.96 -40.8 91.62 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 118.605 0.639 . . . . 0.0 110.787 178.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.497 ' HB3' HD11 ' A' ' 143' ' ' ILE . 47.6 mt-30 -69.97 -29.0 66.0 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.504 0.593 . . . . 0.0 110.877 -175.415 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 34.5 mt -75.77 -52.73 9.78 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.942 0.897 . . . . 0.0 109.195 169.725 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 38.5 mt -57.61 -20.66 34.35 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.97 0.908 . . . . 0.0 113.294 -176.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 76.4 p -114.25 10.85 17.3 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.679 1.192 . . . . 0.0 111.249 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.98 110.92 1.48 Allowed 'General case' 0 C--N 1.344 0.35 0 C-N-CA 124.167 0.987 . . . . 0.0 110.287 -179.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 10.5 m -74.67 -10.84 59.91 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.567 0.747 . . . . 0.0 112.157 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 3.6 p -158.1 152.64 24.72 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.997 0.817 . . . . 0.0 108.997 -172.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -59.26 -34.96 72.87 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.634 1.174 . . . . 0.0 110.774 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -35.21 60.15 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 124.561 1.144 . . . . 0.0 113.819 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -73.14 -34.92 66.38 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 123.447 0.699 . . . . 0.0 110.173 -177.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 mp -61.9 -46.31 89.93 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-N 119.978 1.263 . . . . 0.0 109.019 172.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.71 -29.93 71.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.479 0.712 . . . . 0.0 112.637 177.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -68.63 -44.85 73.35 Favored 'General case' 0 C--N 1.332 -0.163 0 O-C-N 121.169 -0.957 . . . . 0.0 110.421 174.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.497 HD11 ' HB3' ' A' ' 130' ' ' GLN . 68.8 mt -62.34 -38.58 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 C-N-CA 124.229 1.011 . . . . 0.0 109.884 177.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' ILE . . . . . 0.425 HG21 ' CD1' ' A' ' 7' ' ' PHE . 12.7 mm -55.79 -56.15 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.062 0 C-N-CA 123.722 0.809 . . . . 0.0 109.289 169.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 40.7 m -64.36 -26.46 68.48 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.887 0.475 . . . . 0.0 111.279 -170.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -58.94 -27.88 65.72 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.836 1.654 . . . . 0.0 113.362 173.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.936 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 -173.957 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.2 tpp . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.96 114.52 3.12 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 168.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -56.92 -43.57 81.55 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.978 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.97 -26.37 14.99 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.407 1.483 . . . . 0.0 112.955 -176.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -59.43 -28.55 67.05 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 118.888 0.767 . . . . 0.0 111.971 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -91.21 -12.56 34.94 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 117.545 -1.217 . . . . 0.0 112.859 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -114.02 85.66 10.35 Favored Pre-proline 0 N--CA 1.473 0.703 0 CA-C-N 121.607 2.003 . . . . 0.0 107.832 -173.199 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -57.92 -53.64 4.15 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.224 2.616 . . . . 0.0 116.412 -169.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.523 ' C ' ' H ' ' A' ' 11' ' ' SER . 41.6 tt0 -159.64 -88.3 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.041 0.837 . . . . 0.0 113.191 -169.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.9 m -68.77 16.23 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.884 1.674 . . . . 0.0 111.162 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.523 ' H ' ' C ' ' A' ' 9' ' ' GLU . 8.7 m -76.92 10.08 2.51 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 128.174 2.589 . . . . 0.0 112.785 -168.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.6 mm -139.4 130.11 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 N-CA-C 104.071 -2.566 . . . . 0.0 104.071 -171.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.6 m -157.24 136.39 11.86 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 119.625 1.102 . . . . 0.0 110.621 171.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.6 p -106.03 139.66 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 168.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.8 mt -135.89 143.86 35.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 124.255 1.022 . . . . 0.0 108.315 -168.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 39.6 m80 -67.95 -35.22 78.02 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.925 0.49 . . . . 0.0 111.959 177.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -174.42 144.23 0.89 Allowed 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.201 1.8 . . . . 0.0 106.431 176.459 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.411 ' HB3' HG21 ' A' ' 88' ' ' VAL . . . -80.3 150.24 30.04 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 169.705 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -59.41 -41.29 89.16 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.127 0.571 . . . . 0.0 110.977 -178.11 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -167.16 -176.24 3.25 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 126.531 1.933 . . . . 0.0 108.052 172.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 24.1 p-90 -68.69 -30.73 69.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.897 0.771 . . . . 0.0 112.817 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.504 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.0 mt-30 -60.83 -47.51 86.01 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 171.31 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.87 -35.71 79.12 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 121.201 -0.937 . . . . 0.0 111.666 176.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.0 -34.07 77.17 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.881 -0.512 . . . . 0.0 110.65 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.72 -46.52 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 171.72 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -56.46 -46.59 80.3 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 118.227 0.467 . . . . 0.0 110.331 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -62.98 -34.34 77.33 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 117.98 -1.01 . . . . 0.0 111.561 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.2 m -63.85 -21.72 66.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.937 1.244 . . . . 0.0 112.484 174.246 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.0 mmt -123.51 -17.58 6.44 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -169.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -58.25 -35.4 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 120.3 1.409 . . . . 0.0 112.399 -169.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 m -60.48 -36.19 77.7 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 119.217 0.917 . . . . 0.0 110.819 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.6 mt -78.62 -40.44 34.33 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.152 0.981 . . . . 0.0 109.199 178.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 43.0 tp -56.99 -40.97 77.55 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.337 0.517 . . . . 0.0 110.24 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -68.11 -32.44 72.75 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 124.733 1.213 . . . . 0.0 113.252 -172.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -96.68 17.89 15.49 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.31 0.505 . . . . 0.0 110.672 172.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.43 0.0 OUTLIER 44.18 40.85 3.83 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.579 2.351 . . . . 0.0 115.979 -171.27 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -66.71 -20.4 65.96 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.195 -0.941 . . . . 0.0 109.372 167.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.7 pt -143.57 168.87 11.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 C-N-CA 126.928 2.091 . . . . 0.0 108.419 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 64.4 p -101.13 165.88 11.07 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.831 1.252 . . . . 0.0 108.889 169.172 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.4 -30.29 70.46 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.266 -0.897 . . . . 0.0 111.86 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -59.46 -33.68 71.59 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 121.931 -0.481 . . . . 0.0 111.604 177.161 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -59.84 -41.68 91.92 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.344 0.658 . . . . 0.0 111.199 -177.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.6 mp -59.26 -49.51 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -67.36 -29.17 68.64 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 121.61 -0.681 . . . . 0.0 112.757 -178.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.11 -43.48 78.19 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.688 0.676 . . . . 0.0 110.907 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 51.1 mt -69.36 -44.75 80.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 178.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.504 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.8 mttt -63.22 -41.08 99.08 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.611 -0.681 . . . . 0.0 111.077 -176.197 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.16 -39.61 94.36 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.316 1.046 . . . . 0.0 110.623 176.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.0 m -62.59 -36.86 84.05 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.996 -0.44 . . . . 0.0 110.539 172.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 23.9 m . . . . . 0 CA--C 1.537 0.478 0 C-N-CA 123.479 0.712 . . . . 0.0 110.39 177.95 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 . . . . . 0 N--CA 1.449 -0.514 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.6 mm -133.16 140.38 47.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -114.84 -31.62 6.06 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.025 0.53 . . . . 0.0 111.164 175.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -156.45 158.56 31.5 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 125.469 1.508 . . . . 0.0 107.376 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.12 124.09 9.76 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.473 2.115 . . . . 0.0 110.104 169.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.66 -0.08 88.01 Favored Glycine 0 CA--C 1.537 1.417 0 CA-C-O 117.791 -1.561 . . . . 0.0 115.077 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.3 t -127.78 111.08 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 119.986 1.893 . . . . 0.0 108.033 -176.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -107.74 167.65 9.82 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 123.881 0.872 . . . . 0.0 110.027 174.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.4 ttm -141.05 61.58 14.68 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 176.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -52.17 143.04 43.57 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 121.901 1.734 . . . . 0.0 113.902 -171.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -178.4 154.33 0.8 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 128.472 2.709 . . . . 0.0 106.388 -170.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -136.65 153.28 50.96 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.961 1.704 . . . . 0.0 107.621 169.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 38.2 mtm105 -53.56 143.16 38.81 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.33 -178.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -45.5 -43.17 18.05 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.901 3.067 . . . . 0.0 114.145 -171.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.2 -13.53 18.81 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.687 1.195 . . . . 0.0 113.975 -177.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.1 m -75.88 -7.15 53.85 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.774 0.83 . . . . 0.0 111.954 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 135.75 14.21 1.03 Allowed Glycine 0 CA--C 1.525 0.705 0 CA-C-O 118.434 -1.203 . . . . 0.0 113.547 177.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.87 144.79 52.41 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 119.904 1.852 . . . . 0.0 109.304 169.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.5 mt -129.68 -32.71 1.89 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 124.854 1.261 . . . . 0.0 110.479 -173.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -143.39 164.76 29.38 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 126.149 1.78 . . . . 0.0 107.968 174.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.6 m -97.07 130.94 44.3 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 123.218 0.607 . . . . 0.0 110.587 -178.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.46 -179.07 45.77 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 124.954 1.264 . . . . 0.0 110.737 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 47.1 mtt -143.9 171.09 14.71 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 126.46 1.904 . . . . 0.0 110.706 -175.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.85 161.7 41.3 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 126.427 1.891 . . . . 0.0 107.872 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.3 tp -141.54 117.56 10.57 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.336 1.855 . . . . 0.0 107.274 -172.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 69.6 m -123.37 141.72 51.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.423 HD11 ' HA ' ' A' ' 132' ' ' LEU . 13.9 tp -133.25 146.35 51.34 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 171.235 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.17 135.61 53.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.368 1.067 . . . . 0.0 108.573 174.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.05 -40.55 87.14 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 168.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -123.06 94.01 4.13 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.758 2.023 . . . . 0.0 106.825 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -53.93 160.98 4.02 Favored Glycine 0 CA--C 1.526 0.754 0 C-N-CA 124.885 1.231 . . . . 0.0 113.491 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.411 HG21 ' HB3' ' A' ' 18' ' ' ALA . 76.0 t -123.73 149.87 27.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -112.21 108.64 17.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.079 0.466 . . . . 0.0 111.832 -167.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 169.147 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo . . . . . 0 N--CA 1.46 -0.453 0 CA-C-O 120.819 0.258 . . . . 0.0 111.809 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 26.4 mm -72.79 128.55 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 175.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -104.74 -15.38 15.25 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 117.239 -1.363 . . . . 0.0 111.134 170.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 48.9 tp -141.1 132.11 26.16 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 120.467 1.485 . . . . 0.0 109.645 -171.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.8 mp -137.47 132.43 33.32 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.657 ' HB ' HD11 ' A' ' 122' ' ' LEU . 3.0 mt -112.94 117.21 54.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 168.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.51 147.41 35.62 Favored Glycine 0 N--CA 1.443 -0.852 0 N-CA-C 108.465 -1.854 . . . . 0.0 108.465 169.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.445 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -141.95 138.65 32.11 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 103.277 -2.86 . . . . 0.0 103.277 169.088 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.445 ' N ' HD23 ' A' ' 103' ' ' LEU . 5.2 m -140.71 143.99 35.34 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 169.41 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.23 136.96 26.98 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 118.399 0.545 . . . . 0.0 109.734 -169.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.92 -22.05 59.82 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.03 0.532 . . . . 0.0 112.097 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -146.31 155.54 42.71 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.973 0.909 . . . . 0.0 109.758 -178.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.43 74.29 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -177.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.59 -31.58 62.08 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 120.807 -1.183 . . . . 0.0 110.946 177.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.7 m -64.49 -39.33 93.6 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.993 -0.442 . . . . 0.0 110.161 170.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.9 t60 -58.8 -48.84 79.87 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 123.541 0.737 . . . . 0.0 110.054 171.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 12.2 mm -56.01 -53.02 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.472 0.709 . . . . 0.0 109.168 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.24 -39.35 94.47 Favored Glycine 0 CA--C 1.529 0.966 0 CA-C-N 118.931 0.787 . . . . 0.0 111.929 -177.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.84 -53.48 21.18 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.506 1.122 . . . . 0.0 110.64 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.3 mm -49.89 -47.54 22.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 125.746 1.619 . . . . 0.0 108.883 173.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -67.72 -10.95 57.02 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.427 -0.795 . . . . 0.0 112.384 -177.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.35 -48.33 6.72 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.146 0.979 . . . . 0.0 109.509 170.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.481 HD12 ' N ' ' A' ' 119' ' ' SER . 1.9 pp -70.33 -22.73 62.77 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -176.325 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' SER . . . . . 0.481 ' N ' HD12 ' A' ' 118' ' ' LEU . 44.2 m -63.18 -23.24 67.34 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 123.522 0.729 . . . . 0.0 111.475 173.069 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -66.84 -17.45 64.89 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.522 -0.736 . . . . 0.0 110.122 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 38.0 mt -108.1 -61.87 1.52 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.822 1.249 . . . . 0.0 110.951 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.657 HD11 ' HB ' ' A' ' 101' ' ' ILE . 72.8 mt -69.63 -8.62 49.14 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.21 1.404 . . . . 0.0 114.206 -173.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.1 m -120.09 27.68 8.51 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.843 0.857 . . . . 0.0 110.64 175.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -131.44 101.62 5.6 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 125.316 1.446 . . . . 0.0 107.515 176.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -56.8 -27.62 60.13 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.657 0.783 . . . . 0.0 112.217 -177.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -63.13 -48.53 78.12 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 123.465 0.706 . . . . 0.0 109.789 176.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.28 -43.26 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 C-N-CA 123.945 0.898 . . . . 0.0 109.016 177.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.46 HD21 ' HA ' ' A' ' 122' ' ' LEU . 47.5 mt -55.73 -43.2 76.34 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.989 -175.008 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -66.99 -38.9 86.87 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.479 0.581 . . . . 0.0 110.711 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -70.97 -34.7 71.68 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 118.78 0.718 . . . . 0.0 109.863 -175.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 35.1 mt -67.91 -54.35 19.49 Favored 'General case' 0 C--O 1.224 -0.27 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 170.062 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' LEU . . . . . 0.423 ' HA ' HD11 ' A' ' 83' ' ' LEU . 29.5 mt -56.57 -23.61 41.59 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -175.152 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 69.6 p -109.45 5.62 23.51 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.434 1.093 . . . . 0.0 111.876 -178.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.03 106.33 0.82 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 124.271 1.028 . . . . 0.0 110.68 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.5 p -75.55 -1.86 26.38 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.033 1.333 . . . . 0.0 112.999 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 21.4 p -149.78 155.4 40.05 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.04 0.936 . . . . 0.0 110.714 -177.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -58.62 -39.28 80.03 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.506 1.122 . . . . 0.0 109.577 173.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -34.26 74.93 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.06 -178.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -63.17 -44.14 96.3 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.603 0.638 . . . . 0.0 110.941 174.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.6 mt -63.54 -49.07 74.9 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.56 -35.13 71.87 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 173.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -66.74 -43.09 85.11 Favored 'General case' 0 C--N 1.331 -0.197 0 O-C-N 120.962 -1.086 . . . . 0.0 109.86 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 82.9 mt -66.75 -35.16 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 C-N-CA 123.661 0.784 . . . . 0.0 109.199 179.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.1 mm -58.54 -53.14 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 169.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 25.3 m -63.0 -28.76 70.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 122.747 0.419 . . . . 0.0 111.61 -171.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -60.01 -28.28 67.59 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 126.212 1.805 . . . . 0.0 113.565 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.869 0 CA-C-O 117.935 -1.481 . . . . 0.0 109.5 -173.245 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.222 0.058 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -66.21 110.21 2.93 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 173.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -59.46 -32.63 70.41 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 171.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.58 -18.47 11.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.103 0.961 . . . . 0.0 112.443 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -66.09 -22.45 66.4 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 118.883 0.765 . . . . 0.0 112.772 176.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -102.76 -4.85 24.38 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 117.039 -1.458 . . . . 0.0 114.215 -169.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -116.16 88.07 21.43 Favored Pre-proline 0 N--CA 1.475 0.815 0 CA-C-N 122.116 2.234 . . . . 0.0 109.245 -170.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_exo -40.65 -73.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.808 1 C-N-CA 125.723 4.282 . . . . 0.0 116.448 -174.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.448 ' C ' ' H ' ' A' ' 11' ' ' SER . 37.2 tt0 -163.32 -76.72 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.832 0.853 . . . . 0.0 111.252 -171.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.67 6.8 0.58 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.774 1.63 . . . . 0.0 111.914 175.336 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . 0.448 ' H ' ' C ' ' A' ' 9' ' ' GLU . 3.5 m -73.94 -0.85 17.43 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.571 2.348 . . . . 0.0 113.626 -168.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.6 mt -133.48 134.5 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 -169.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.7 m -156.41 151.71 26.62 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.496 0.718 . . . . 0.0 110.939 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.9 t -118.74 142.22 34.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 169.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.421 HG22 ' H ' ' A' ' 17' ' ' SER . 15.3 mt -139.41 147.69 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.227 1.811 . . . . 0.0 106.216 -171.138 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -68.65 -45.54 71.5 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.231 -0.918 . . . . 0.0 110.375 169.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.421 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -170.6 145.95 2.63 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.918 1.687 . . . . 0.0 106.455 -177.861 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.29 159.22 27.32 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 174.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt -59.09 -35.7 73.86 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.404 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -164.6 -179.28 5.84 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 127.328 2.251 . . . . 0.0 106.8 170.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 41.8 p-90 -64.97 -33.78 76.86 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.209 -0.932 . . . . 0.0 112.194 171.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.443 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 48.8 mt-30 -55.27 -45.23 76.15 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.75 1.22 . . . . 0.0 108.485 170.009 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -71.04 -33.56 70.41 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 121.23 -0.919 . . . . 0.0 110.817 177.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.42 -35.08 79.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 121.573 -0.704 . . . . 0.0 110.786 -178.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.94 -47.07 86.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 170.485 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.46 -42.24 82.13 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 118.469 0.577 . . . . 0.0 110.604 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -64.68 -33.1 75.16 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.167 0.987 . . . . 0.0 111.614 173.18 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.9 m -67.16 -17.97 65.07 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.831 1.196 . . . . 0.0 112.03 173.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.1 mmt -125.57 -23.48 4.06 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -168.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 p -60.25 -36.91 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 120.837 1.653 . . . . 0.0 111.684 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.0 m -67.16 -19.54 65.61 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 118.594 0.634 . . . . 0.0 112.119 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 79.9 mt -86.33 -43.46 12.86 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.908 0.883 . . . . 0.0 109.115 169.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 35.8 tp -56.61 -43.2 79.94 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.92 0.888 . . . . 0.0 110.66 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -67.65 -23.49 65.34 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 125.865 1.666 . . . . 0.0 113.931 -171.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -114.49 26.1 10.5 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.057 0.389 . . . . 0.0 110.592 171.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 60.82 26.38 16.22 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 170.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.405 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 68.0 m-85 -66.97 -23.05 65.9 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.165 -0.959 . . . . 0.0 110.647 169.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.5 pt -142.06 179.61 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 126.702 2.001 . . . . 0.0 107.975 178.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.8 p -123.17 162.65 22.13 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.816 1.646 . . . . 0.0 108.727 170.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.05 -31.68 67.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.06 0.944 . . . . 0.0 113.076 -169.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -60.16 -33.5 72.27 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.746 -0.596 . . . . 0.0 111.794 177.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -59.48 -41.51 89.97 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.722 0.809 . . . . 0.0 110.647 -177.158 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.12 -52.09 64.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 123.446 0.699 . . . . 0.0 109.552 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -68.9 -26.84 65.3 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -176.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.71 -41.37 73.71 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.024 0.829 . . . . 0.0 111.03 173.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 33.5 mt -70.29 -45.65 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.443 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.5 mttt -66.64 -39.9 88.47 Favored 'General case' 0 C--O 1.224 -0.266 0 O-C-N 121.989 -0.444 . . . . 0.0 111.445 -175.528 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.45 -41.43 98.73 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.24 1.016 . . . . 0.0 110.301 178.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -64.83 -40.85 95.84 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.411 0.684 . . . . 0.0 110.508 173.204 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 27.8 m . . . . . 0 CA--C 1.54 0.579 0 O-C-N 121.606 -0.684 . . . . 0.0 111.2 174.661 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 . . . . . 0 N--CA 1.454 -0.231 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.5 mm -138.24 134.19 44.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 104.77 -2.308 . . . . 0.0 104.77 -174.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -123.71 -28.5 3.84 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 123.468 0.707 . . . . 0.0 111.261 -169.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.22 162.91 23.16 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 125.717 1.607 . . . . 0.0 107.322 175.266 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.1 117.98 3.22 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.694 2.263 . . . . 0.0 110.893 169.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.85 1.01 77.42 Favored Glycine 0 CA--C 1.53 0.97 0 CA-C-O 117.931 -1.483 . . . . 0.0 114.064 178.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.3 t -128.9 118.91 48.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 119.803 1.801 . . . . 0.0 108.698 -169.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -121.31 166.89 13.39 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.554 1.542 . . . . 0.0 110.104 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.0 ttm -135.8 60.63 37.1 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 123.166 0.586 . . . . 0.0 110.163 172.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -59.3 121.22 9.54 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 121.946 1.764 . . . . 0.0 110.15 -171.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -172.5 162.49 5.28 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 127.634 2.374 . . . . 0.0 107.173 -169.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.87 172.42 13.04 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.709 1.204 . . . . 0.0 109.867 -174.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -58.5 154.01 36.28 Favored Pre-proline 0 CA--C 1.537 0.467 0 CA-C-O 118.468 -0.777 . . . . 0.0 109.605 173.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.55 -40.03 83.74 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.462 2.108 . . . . 0.0 109.972 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -64.61 -12.59 47.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.402 1.481 . . . . 0.0 112.94 -176.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 80.9 m -77.34 -5.37 49.35 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.777 0.717 . . . . 0.0 111.965 178.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 130.69 18.44 1.41 Allowed Glycine 0 CA--C 1.524 0.607 0 CA-C-O 118.405 -1.219 . . . . 0.0 113.112 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.09 146.07 53.81 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 119.281 1.541 . . . . 0.0 109.026 169.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.8 mt -132.77 -29.47 1.5 Allowed 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 123.973 0.909 . . . . 0.0 111.183 -173.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.405 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 64.5 mttt -147.17 156.15 42.73 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.031 1.332 . . . . 0.0 107.827 177.456 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 93.7 m -88.28 128.57 35.48 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 123.04 0.536 . . . . 0.0 111.057 -176.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -176.92 -178.8 46.95 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.347 1.451 . . . . 0.0 110.854 -176.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.659 ' SD ' HD21 ' A' ' 118' ' ' LEU . 53.5 mtt -148.57 172.46 14.49 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 127.018 2.127 . . . . 0.0 110.077 -175.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.7 m -152.75 168.21 26.45 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.209 1.403 . . . . 0.0 109.157 169.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.421 HD22 HD11 ' A' ' 144' ' ' ILE . 12.9 tp -145.59 125.51 13.56 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.448 1.899 . . . . 0.0 108.737 -169.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 73.2 m -133.56 145.33 49.99 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.974 1.31 . . . . 0.0 108.296 -176.319 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.472 HD23 ' N ' ' A' ' 84' ' ' LEU . 5.6 tt -136.29 132.77 36.16 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 174.259 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.472 ' N ' HD23 ' A' ' 83' ' ' LEU . 9.2 mp -114.09 121.31 43.44 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 126.865 2.066 . . . . 0.0 106.376 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -60.77 -36.91 80.17 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.247 0.93 . . . . 0.0 112.745 -177.32 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -92.96 -14.93 26.86 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.286 0.634 . . . . 0.0 112.156 176.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.97 -176.44 21.67 Favored Glycine 0 CA--C 1.534 1.271 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 -168.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.2 p -150.66 164.43 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 O-C-N 121.663 -0.904 . . . . 0.0 108.659 169.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -102.37 110.71 22.74 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.458 0.647 . . . . 0.0 109.837 -169.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 . . . . . 0 CA--C 1.539 0.534 0 C-N-CA 125.594 1.558 . . . . 0.0 108.118 170.148 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo . . . . . 0 N--CA 1.452 -0.966 0 N-CA-C 109.22 -1.108 . . . . 0.0 109.22 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 31.4 mm -72.38 107.74 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 178.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 32.0 mtpt -84.59 -18.86 34.2 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-O 117.094 -1.431 . . . . 0.0 111.513 171.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 8.4 mt -137.97 139.24 39.6 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 120.703 1.592 . . . . 0.0 111.837 -174.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mp -140.7 134.63 30.63 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 -175.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.64 HG21 HD22 ' A' ' 118' ' ' LEU . 5.0 mt -119.94 126.49 75.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 169.404 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.18 153.58 28.01 Favored Glycine 0 CA--C 1.522 0.517 0 N-CA-C 108.834 -1.706 . . . . 0.0 108.834 169.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.516 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -149.99 144.26 25.72 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 105.344 -2.095 . . . . 0.0 105.344 173.877 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.516 ' N ' HD23 ' A' ' 103' ' ' LEU . 79.5 p -142.29 146.38 35.01 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 105.565 -2.013 . . . . 0.0 105.565 168.25 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.665 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -144.15 148.17 34.67 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 171.018 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -83.78 -13.85 52.88 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.012 -174.062 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -135.5 152.53 51.42 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.619 0.768 . . . . 0.0 110.171 174.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.27 -35.23 76.73 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -177.57 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -72.22 -31.17 65.61 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.09 -1.006 . . . . 0.0 110.808 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.505 ' HB2' ' HB1' ' A' ' 105' ' ' ALA . 16.3 m -63.84 -38.82 92.52 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 118.719 -0.658 . . . . 0.0 109.658 169.675 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.665 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 24.8 m-70 -61.93 -43.33 99.07 Favored 'General case' 0 C--N 1.344 0.345 0 CA-C-N 119.401 1.0 . . . . 0.0 110.767 172.456 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.8 mm -57.82 -55.57 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 119.428 1.013 . . . . 0.0 109.331 177.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -58.92 -39.32 93.92 Favored Glycine 0 CA--C 1.528 0.849 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.435 ' CB ' HD21 ' A' ' 103' ' ' LEU . . . -67.51 -49.05 65.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.308 1.043 . . . . 0.0 111.267 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.4 mm -56.36 -42.95 75.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.231 1.013 . . . . 0.0 108.643 176.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -70.98 -12.35 61.49 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.75 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -82.98 -45.51 14.01 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 169.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.659 HD21 ' SD ' ' A' ' 79' ' ' MET . 92.5 mt -71.54 -26.94 62.85 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 118.887 -0.578 . . . . 0.0 112.062 -174.239 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.1 m -60.83 -24.43 65.86 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.096 0.407 . . . . 0.0 111.591 170.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.53 -16.41 62.33 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.748 -1.22 . . . . 0.0 110.688 175.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 42.2 mt -104.52 -67.56 0.9 Allowed 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.322 1.049 . . . . 0.0 109.713 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 16.9 mt -75.48 -6.35 49.71 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -171.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 33.4 m -119.86 29.7 7.42 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.175 0.898 . . . . 0.0 110.457 174.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -131.33 108.5 9.69 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 172.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -57.68 -27.38 62.83 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.632 -177.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -63.78 -45.25 90.6 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.25 0.62 . . . . 0.0 110.003 176.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.54 -41.23 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 118.409 -0.805 . . . . 0.0 109.135 175.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 35.3 mt -56.14 -39.78 72.78 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 119.34 0.973 . . . . 0.0 111.231 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -69.87 -37.33 76.05 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.01 176.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -65.35 -41.44 93.85 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 119.336 0.971 . . . . 0.0 109.106 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 22.9 mt -66.19 -52.85 44.12 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 175.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 51.1 mt -59.37 -17.4 29.66 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 77.6 p -108.24 3.2 23.36 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.629 1.172 . . . . 0.0 112.09 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.45 140.19 58.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.403 1.081 . . . . 0.0 109.257 169.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -132.46 1.84 3.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.028 1.331 . . . . 0.0 111.234 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.2 m -144.28 150.62 38.19 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.115 0.966 . . . . 0.0 109.442 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.2 -43.16 92.25 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.957 1.303 . . . . 0.0 110.649 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -60.02 -35.29 74.76 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 123.054 0.542 . . . . 0.0 111.287 177.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -64.56 -40.34 95.39 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.948 0.899 . . . . 0.0 111.161 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.1 mt -65.61 -46.15 80.4 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.31 69.27 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 174.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -65.57 -38.18 88.81 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 120.52 -1.363 . . . . 0.0 109.913 174.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 66.2 mt -69.55 -35.47 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 C-N-CA 124.141 0.976 . . . . 0.0 109.562 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' ILE . . . . . 0.421 HD11 HD22 ' A' ' 81' ' ' LEU . 27.9 mm -56.26 -50.75 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 169.389 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 18.7 m -65.12 -30.61 71.55 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 123.281 0.363 . . . . 0.0 110.966 -173.427 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -60.11 -27.61 67.17 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.218 1.407 . . . . 0.0 113.296 172.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 N-CA-C 108.79 -1.724 . . . . 0.0 108.79 -179.028 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.467 0.175 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.21 109.01 3.38 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 172.145 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -58.36 -31.69 67.85 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.6 -21.1 2.33 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.931 1.692 . . . . 0.0 113.319 177.186 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -64.02 -25.19 68.01 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.304 0.957 . . . . 0.0 113.468 174.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -101.19 -21.66 14.87 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -169.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -103.97 103.99 40.76 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 -170.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -59.19 -68.04 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.511 2.807 . . . . 0.0 113.968 -171.679 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -163.28 -74.73 0.04 OUTLIER 'General case' 0 CA--C 1.521 -0.164 0 C-N-CA 124.155 0.982 . . . . 0.0 111.028 -173.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.13 3.11 1.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.104 1.362 . . . . 0.0 111.917 177.532 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -15.28 63.5 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.815 1.646 . . . . 0.0 113.24 -169.651 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.4 mp -117.83 137.27 52.3 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 -171.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.1 m -156.97 139.86 15.26 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.572 0.624 . . . . 0.0 110.917 176.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 92.7 t -105.0 137.11 35.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 104.764 -2.31 . . . . 0.0 104.764 169.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 40.9 mt -137.74 148.81 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 -176.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -66.05 -45.82 79.99 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.584 -0.697 . . . . 0.0 110.733 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -164.9 144.39 6.98 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.815 1.246 . . . . 0.0 108.144 -176.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.23 156.75 28.0 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 169.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -60.05 -40.92 91.07 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.576 176.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -167.41 -177.49 3.63 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 128.201 2.6 . . . . 0.0 107.505 171.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -62.17 -34.15 75.88 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.479 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.5 mt-30 -60.66 -48.43 81.81 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.578 1.535 . . . . 0.0 107.906 173.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -62.64 -35.86 80.96 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 121.307 -0.871 . . . . 0.0 111.451 176.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.93 82.4 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.766 -0.584 . . . . 0.0 110.544 -178.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -65.64 -47.89 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 172.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -58.44 -48.02 82.08 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 118.434 0.561 . . . . 0.0 110.762 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -59.7 -30.01 68.49 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.287 1.035 . . . . 0.0 111.356 174.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 31.5 m -84.58 -9.91 57.87 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 119.383 0.992 . . . . 0.0 113.565 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.2 mmt -124.72 -21.52 4.78 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 119.99 1.268 . . . . 0.0 112.757 -172.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.22 -37.28 55.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 120.489 1.495 . . . . 0.0 111.125 -175.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 m -64.48 -25.71 68.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.598 -0.689 . . . . 0.0 112.425 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.6 mt -87.51 -40.98 13.83 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.127 0.971 . . . . 0.0 109.061 175.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.2 tp -56.15 -41.72 75.84 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.563 1.145 . . . . 0.0 110.4 176.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.67 -32.64 74.31 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 125.426 1.49 . . . . 0.0 112.673 -174.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.3 mmtt -94.69 15.84 17.21 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.217 0.462 . . . . 0.0 110.818 173.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.33 3.5 p30 46.89 42.57 12.36 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.889 1.675 . . . . 0.0 114.079 -172.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -69.88 -21.84 63.29 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.501 -0.749 . . . . 0.0 109.324 168.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.6 pt -147.12 170.43 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 127.096 2.158 . . . . 0.0 108.159 -174.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.8 p -105.85 168.13 9.32 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.039 1.336 . . . . 0.0 109.187 169.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.89 -30.06 71.18 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.254 -0.904 . . . . 0.0 111.997 -175.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -60.59 -32.55 71.65 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 121.788 -0.57 . . . . 0.0 111.474 175.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -59.88 -43.42 94.74 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.539 0.609 . . . . 0.0 110.563 -177.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.1 mp -55.33 -50.11 67.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 123.315 0.646 . . . . 0.0 109.365 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -71.43 -25.38 62.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.665 -0.683 . . . . 0.0 111.923 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.58 -43.82 97.85 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 119.434 1.015 . . . . 0.0 110.801 173.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.4 mt -63.99 -45.41 96.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.8 mttt -61.62 -37.98 85.96 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 122.042 -0.411 . . . . 0.0 110.229 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.45 -43.49 94.1 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 119.083 0.856 . . . . 0.0 111.33 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 49.4 m -59.12 -38.75 80.34 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.753 0.706 . . . . 0.0 110.611 171.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.5 m . . . . . 0 CA--C 1.539 0.524 0 C-N-CA 123.564 0.746 . . . . 0.0 111.064 178.194 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.231 0.108 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.5 mm -141.01 134.54 31.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 103.114 -2.921 . . . . 0.0 103.114 -178.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mp -130.62 -21.2 2.82 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -169.323 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.29 160.43 30.45 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 172.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -57.67 121.36 9.89 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 121.927 1.751 . . . . 0.0 109.565 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.54 2.53 76.08 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-O 117.895 -1.503 . . . . 0.0 114.445 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.7 t -133.39 118.67 32.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-N 120.312 2.056 . . . . 0.0 109.275 -169.428 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -116.19 163.35 16.1 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.362 1.465 . . . . 0.0 109.818 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 7.5 ttm -137.79 61.08 27.54 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-O 118.59 -0.719 . . . . 0.0 109.862 171.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . 0.28 93.7 Cg_exo -31.22 -85.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.016 1 C-N-CA 125.786 4.324 . . . . 0.0 118.763 -168.305 . . . . . . . . 3 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 54.72 164.13 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 126.905 2.082 . . . . 0.0 114.61 -176.402 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -141.97 155.87 45.46 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 126.478 1.911 . . . . 0.0 106.916 170.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -50.86 147.75 8.31 Favored Pre-proline 0 CA--C 1.536 0.42 0 CA-C-O 118.08 -0.962 . . . . 0.0 110.034 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_exo -46.68 -41.97 24.18 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.217 2.611 . . . . 0.0 112.876 176.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -61.6 -14.28 29.1 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.799 1.24 . . . . 0.0 113.842 -177.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.2 m -79.84 -3.08 46.31 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.712 0.805 . . . . 0.0 112.247 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.66 18.92 1.72 Allowed Glycine 0 C--N 1.336 0.562 0 CA-C-O 118.748 -1.029 . . . . 0.0 112.959 175.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.4 148.67 49.29 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 119.468 1.634 . . . . 0.0 109.269 170.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 76.5 mt -131.9 -32.25 1.45 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 124.828 1.251 . . . . 0.0 110.77 -175.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -143.31 163.15 33.79 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.942 1.697 . . . . 0.0 107.816 178.047 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.3 m -97.71 122.62 41.01 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 123.189 0.596 . . . . 0.0 109.91 -177.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -168.88 179.83 41.44 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.25 1.405 . . . . 0.0 111.348 -176.078 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.7 ' SD ' HD21 ' A' ' 118' ' ' LEU . 52.1 mtt -149.02 168.34 23.39 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.44 1.496 . . . . 0.0 111.23 -170.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.2 p -148.54 164.91 32.8 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.454 1.502 . . . . 0.0 109.852 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.523 HD22 HD11 ' A' ' 144' ' ' ILE . 21.1 tp -146.28 90.03 1.92 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.602 1.561 . . . . 0.0 109.923 -169.517 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.1 m -97.45 143.75 27.86 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.0 tp -133.25 136.78 45.76 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 169.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -115.69 116.34 27.91 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 104.705 -2.331 . . . . 0.0 104.705 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.42 -33.44 75.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 118.701 0.682 . . . . 0.0 112.328 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -85.48 -13.43 49.14 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.919 0.888 . . . . 0.0 111.722 173.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 68.75 177.23 13.7 Favored Glycine 0 CA--C 1.533 1.181 0 N-CA-C 110.265 -1.134 . . . . 0.0 110.265 -168.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -146.12 161.15 10.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 168.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.95 103.0 11.96 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 121.409 -0.807 . . . . 0.0 110.024 -169.263 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 . . . . . 0 CA--C 1.538 0.497 0 CA-C-N 114.924 -1.035 . . . . 0.0 109.097 170.775 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo . . . . . 0 CA--C 1.534 0.524 0 N-CA-C 114.041 0.746 . . . . 0.0 114.041 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 27.0 mm -108.1 123.5 63.68 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -89.05 -32.52 17.53 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-O 116.819 -1.562 . . . . 0.0 109.878 169.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.46 HD22 HD22 ' A' ' 131' ' ' LEU . 1.9 tp -130.49 144.09 51.18 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 121.1 1.773 . . . . 0.0 112.297 -172.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.3 mp -132.95 109.16 9.38 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.008 1.323 . . . . 0.0 107.707 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.724 HG21 HD22 ' A' ' 118' ' ' LEU . 0.5 OUTLIER -87.74 115.27 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 104.72 -2.326 . . . . 0.0 104.72 168.729 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.73 153.33 29.77 Favored Glycine 0 CA--C 1.527 0.784 0 N-CA-C 109.321 -1.511 . . . . 0.0 109.321 170.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -145.35 144.35 30.65 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 103.872 -2.64 . . . . 0.0 103.872 171.372 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.434 ' N ' HD23 ' A' ' 103' ' ' LEU . 11.3 m -142.32 142.47 32.51 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 169.364 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -145.1 136.3 24.96 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -170.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.85 -24.46 52.67 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.907 0.483 . . . . 0.0 111.889 -175.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -143.53 157.41 44.46 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.896 0.878 . . . . 0.0 110.081 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.31 -35.12 73.22 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.52 -32.4 60.48 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.904 -1.122 . . . . 0.0 111.033 177.322 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.8 m -62.02 -42.28 99.0 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 169.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 22.2 t60 -57.71 -49.04 77.87 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.134 0.974 . . . . 0.0 110.17 173.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.4 mm -56.41 -54.98 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 118.89 0.768 . . . . 0.0 109.604 179.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.71 -38.85 94.46 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-N 118.549 0.613 . . . . 0.0 111.582 -176.677 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.37 -49.86 57.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.674 1.189 . . . . 0.0 110.901 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.0 mm -55.83 -42.7 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.588 1.155 . . . . 0.0 109.145 176.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.7 mm-40 -69.54 -14.59 62.93 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 118.381 -0.818 . . . . 0.0 111.936 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.85 -42.34 16.51 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 170.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.724 HD22 HG21 ' A' ' 101' ' ' ILE . 96.4 mt -68.76 -29.3 67.66 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 121.78 -0.575 . . . . 0.0 111.708 -177.727 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.1 m -56.61 -22.49 34.33 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 170.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -77.24 -18.29 57.76 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.584 1.084 . . . . 0.0 111.519 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 42.9 mt -103.51 -61.26 1.44 Allowed 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.971 0.908 . . . . 0.0 110.103 -177.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.51 -27.65 69.29 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.92 0.888 . . . . 0.0 113.046 -174.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.5 m -106.93 29.32 7.16 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.134 0.574 . . . . 0.0 110.577 -175.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -130.59 104.88 7.47 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 123.909 0.884 . . . . 0.0 108.686 175.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -58.63 -25.55 62.8 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.08 -177.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.53 -48.22 73.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 121.273 0.559 . . . . 0.0 109.564 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.59 -42.2 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 123.885 0.874 . . . . 0.0 109.013 175.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 45.5 mt -60.86 -33.91 73.8 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 118.714 0.688 . . . . 0.0 111.758 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -69.34 -43.46 73.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 120.821 -1.175 . . . . 0.0 109.587 172.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -62.95 -33.29 75.04 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.864 0.756 . . . . 0.0 110.321 -177.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.46 HD22 HD22 ' A' ' 99' ' ' LEU . 3.8 pp -81.16 -42.0 21.53 Favored 'General case' 0 C--N 1.342 0.241 0 C-N-CA 123.451 0.7 . . . . 0.0 111.2 177.28 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 55.2 mt -64.48 -20.25 66.07 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.551 1.069 . . . . 0.0 111.743 176.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 59.9 p -108.79 16.33 22.86 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.983 1.313 . . . . 0.0 111.167 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.39 102.62 0.71 Allowed 'General case' 0 C--N 1.346 0.42 0 CA-C-N 119.254 0.934 . . . . 0.0 111.18 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.3 m -71.75 -17.0 62.22 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.496 0.718 . . . . 0.0 112.272 175.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.3 p -153.76 162.44 41.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.813 0.733 . . . . 0.0 111.184 -171.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -57.61 -37.24 72.92 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.418 1.087 . . . . 0.0 109.401 169.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -58.39 -44.16 88.81 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-O 118.618 -0.706 . . . . 0.0 110.916 176.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -60.04 -38.13 81.86 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 119.122 0.874 . . . . 0.0 112.121 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 38.3 mt -69.9 -44.77 69.02 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.706 0.685 . . . . 0.0 109.971 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -65.55 -26.58 67.94 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.087 -1.008 . . . . 0.0 112.569 175.692 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -66.15 -35.81 81.47 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 120.344 -1.472 . . . . 0.0 110.826 174.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.44 -39.34 84.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.729 0.811 . . . . 0.0 109.784 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' ILE . . . . . 0.523 HD11 HD22 ' A' ' 81' ' ' LEU . 33.7 mm -58.21 -51.51 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 173.026 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.9 m -65.57 -24.53 67.11 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.469 -169.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ARG . . . . . 0.472 ' HG3' HH11 ' A' ' 146' ' ' ARG . 2.2 ttm-85 -60.19 -25.29 65.46 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.398 1.479 . . . . 0.0 113.825 173.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.973 -0.904 . . . . 0.0 111.065 -173.666 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 tpt . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.43 112.84 1.91 Allowed 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 169.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.56 -34.01 73.53 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 169.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.9 p -59.53 -5.74 0.91 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.921 1.688 . . . . 0.0 113.413 171.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -109.19 11.54 25.44 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.098 1.359 . . . . 0.0 113.341 174.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -130.96 -46.63 1.02 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.34 1.056 . . . . 0.0 109.6 169.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -75.22 118.26 69.27 Favored Pre-proline 0 CA--C 1.542 0.642 0 N-CA-C 104.302 -2.481 . . . . 0.0 104.302 170.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.9 -78.71 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.646 2.231 . . . . 0.0 111.394 -169.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -168.5 165.39 12.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 128.316 2.646 . . . . 0.0 104.88 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 56.99 15.74 2.49 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.711 1.204 . . . . 0.0 113.719 171.395 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.5 m -117.53 28.64 8.33 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.95 1.3 . . . . 0.0 110.489 -169.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 mt -122.73 144.54 31.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 171.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 69.9 m -157.07 157.33 34.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.852 0.861 . . . . 0.0 109.488 169.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 99.2 t -122.21 141.06 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 104.248 -2.501 . . . . 0.0 104.248 170.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.5 mt -136.18 144.11 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 125.29 1.436 . . . . 0.0 107.86 -168.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -70.68 -36.04 73.11 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.159 -0.338 . . . . 0.0 111.24 177.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 p -175.11 146.41 0.85 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 126.299 1.84 . . . . 0.0 106.292 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.28 157.67 20.52 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 169.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -62.7 -37.11 85.18 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.009 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -165.2 -179.46 5.64 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 126.754 2.021 . . . . 0.0 107.125 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 69.0 p-90 -61.78 -35.17 77.37 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.882 0.765 . . . . 0.0 111.864 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.489 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 51.3 mt-30 -51.79 -53.94 34.32 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.64 1.176 . . . . 0.0 108.191 170.661 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -66.57 -34.39 77.78 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 121.684 -0.635 . . . . 0.0 111.185 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.24 -31.56 72.46 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 121.82 -0.55 . . . . 0.0 110.795 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.74 -48.3 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 170.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -56.51 -46.21 80.66 Favored 'General case' 0 C--O 1.223 -0.327 0 O-C-N 122.033 -0.417 . . . . 0.0 110.08 178.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -64.52 -29.32 70.35 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 118.003 -0.998 . . . . 0.0 112.293 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.2 m -66.93 -23.53 65.98 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 120.17 1.35 . . . . 0.0 111.869 172.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.1 mmt -123.79 -17.96 6.19 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 -168.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.8 p -57.17 -34.82 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 120.276 1.398 . . . . 0.0 112.472 -169.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.5 m -64.77 -44.65 89.34 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 118.654 0.661 . . . . 0.0 109.727 178.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 89.3 mt -65.05 -36.67 85.1 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.182 0.593 . . . . 0.0 109.709 177.3 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 51.1 tp -61.61 -48.25 81.76 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.22 0.608 . . . . 0.0 109.924 177.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -65.42 -37.14 86.04 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 124.157 0.983 . . . . 0.0 112.168 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -76.56 2.11 14.84 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.604 1.162 . . . . 0.0 111.859 175.449 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.414 0.0 OUTLIER 48.64 30.34 2.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.703 2.401 . . . . 0.0 116.019 -169.956 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -66.68 -23.66 66.16 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.11 -0.994 . . . . 0.0 109.762 168.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.0 pt -140.88 179.28 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 C-N-CA 126.063 1.745 . . . . 0.0 109.905 -177.613 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 m -121.09 160.53 23.47 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.899 2.08 . . . . 0.0 108.46 175.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.02 -33.23 71.72 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.318 -0.864 . . . . 0.0 112.883 -171.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -59.51 -30.82 68.84 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.864 -0.522 . . . . 0.0 111.885 176.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -61.16 -42.7 99.02 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.312 0.645 . . . . 0.0 110.574 -177.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.4 -50.38 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 174.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -68.78 -25.89 64.93 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.501 -0.762 . . . . 0.0 112.003 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.76 98.22 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 119.473 1.033 . . . . 0.0 110.909 174.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.9 mt -66.96 -44.06 88.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.489 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.6 mttt -60.9 -44.64 96.86 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.352 0.523 . . . . 0.0 109.915 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.69 -37.28 86.75 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.125 0.97 . . . . 0.0 111.47 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.0 m -63.31 -38.02 89.54 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.635 -0.666 . . . . 0.0 110.44 172.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 17.5 m . . . . . 0 CA--C 1.541 0.624 0 C-N-CA 123.434 0.694 . . . . 0.0 110.738 176.615 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.1 mm -135.2 142.42 39.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 126.6 1.96 . . . . 0.0 105.914 -174.479 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mp -132.16 -28.6 1.7 Allowed 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.38 0.672 . . . . 0.0 112.124 -173.003 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.13 164.87 20.2 Favored Pre-proline 0 C--O 1.238 0.47 0 C-N-CA 125.11 1.364 . . . . 0.0 107.596 173.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.13 123.45 11.0 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.28 1.987 . . . . 0.0 109.507 169.278 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.54 3.66 90.43 Favored Glycine 0 CA--C 1.535 1.338 0 CA-C-O 117.892 -1.504 . . . . 0.0 115.204 178.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 58.0 t -128.27 122.76 58.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 120.241 2.021 . . . . 0.0 108.56 -173.241 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.78 163.05 23.71 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 124.948 1.299 . . . . 0.0 110.262 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.2 ttm -132.8 60.46 50.11 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 123.414 0.686 . . . . 0.0 111.64 175.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -50.59 143.62 27.79 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.304 2.003 . . . . 0.0 114.432 -171.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -179.72 154.9 0.62 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 128.205 2.602 . . . . 0.0 106.672 -169.607 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.07 161.66 36.17 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 125.515 1.526 . . . . 0.0 107.631 169.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.6 ptt85 -49.93 139.56 17.08 Favored Pre-proline 0 CA--C 1.54 0.568 0 CA-C-O 118.079 -0.962 . . . . 0.0 109.729 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -46.89 -43.26 24.38 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 123.692 2.928 . . . . 0.0 113.008 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.08 -9.65 11.33 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.484 1.514 . . . . 0.0 114.368 -177.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 64.0 m -76.47 -3.91 39.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.011 0.823 . . . . 0.0 112.388 172.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 132.66 13.29 1.65 Allowed Glycine 0 C--N 1.334 0.456 0 CA-C-O 118.305 -1.275 . . . . 0.0 113.373 171.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.4 145.17 56.16 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.296 1.548 . . . . 0.0 109.231 169.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.0 mt -126.2 -33.92 2.58 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 124.444 1.098 . . . . 0.0 110.261 -175.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -139.52 168.59 19.48 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.103 1.761 . . . . 0.0 107.873 176.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 96.9 m -98.8 118.53 35.75 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 123.351 0.66 . . . . 0.0 109.247 177.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -165.63 177.82 40.7 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 123.804 0.716 . . . . 0.0 112.382 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.721 ' SD ' HD21 ' A' ' 118' ' ' LEU . 59.0 mtt -142.22 166.97 23.24 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.737 1.269 . . . . 0.0 112.841 -171.426 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.2 p -145.58 158.55 43.83 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.264 1.826 . . . . 0.0 108.762 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 mp -134.44 133.16 40.18 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.988 1.315 . . . . 0.0 107.542 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 26.6 m -139.05 134.9 33.6 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -174.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.1 tp -123.56 142.18 51.28 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 169.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.9 mp -121.34 115.98 23.95 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 126.973 2.109 . . . . 0.0 105.584 177.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -62.99 -25.03 68.19 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.115 0.966 . . . . 0.0 112.486 -174.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -110.52 -7.98 14.68 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.8 1.24 . . . . 0.0 111.765 177.089 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 59.39 -176.37 2.94 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 123.842 0.734 . . . . 0.0 112.065 -169.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -151.49 157.92 5.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 169.146 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -98.26 109.77 22.47 Favored 'General case' 0 C--N 1.333 -0.133 0 O-C-N 121.182 -0.949 . . . . 0.0 112.139 -169.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 N--CA 1.449 -0.523 0 N-CA-C 106.241 -1.762 . . . . 0.0 106.241 169.123 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 N--CA 1.46 -0.485 0 N-CA-C 111.612 -0.188 . . . . 0.0 111.612 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 28.4 mm -69.11 119.25 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.1 mtpt -97.14 -17.35 19.97 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.851 -1.071 . . . . 0.0 110.78 174.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.434 HD21 HD13 ' A' ' 131' ' ' LEU . 59.5 tp -142.09 128.44 19.98 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 119.951 1.251 . . . . 0.0 110.412 -169.388 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.1 mp -137.82 113.56 9.71 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -170.477 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.724 HG21 HD22 ' A' ' 118' ' ' LEU . 1.2 mp -100.16 111.56 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 175.289 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.7 147.79 31.33 Favored Glycine 0 CA--C 1.529 0.954 0 N-CA-C 110.065 -1.214 . . . . 0.0 110.065 173.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.34 141.05 37.66 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 171.09 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 28.5 p -131.33 142.34 50.07 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 127.58 2.352 . . . . 0.0 106.533 171.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -145.86 133.6 21.12 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.61 -22.17 57.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 122.818 0.447 . . . . 0.0 111.42 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -145.83 154.49 42.05 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.141 0.977 . . . . 0.0 109.77 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.04 -31.69 69.07 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -177.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -77.61 -32.85 53.77 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.24 0.927 . . . . 0.0 111.373 178.4 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 4.4 m -60.95 -42.88 99.1 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 169.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -48.83 77.01 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.539 1.136 . . . . 0.0 110.51 171.815 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 6.0 mm -58.24 -45.56 88.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 123.37 0.668 . . . . 0.0 110.57 -177.193 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -73.96 -33.64 57.09 Favored Glycine 0 CA--C 1.529 0.917 0 CA-C-N 119.715 1.143 . . . . 0.0 111.597 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.66 -46.96 80.23 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.122 0.969 . . . . 0.0 110.886 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -54.39 -45.04 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 125.076 1.35 . . . . 0.0 108.444 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -69.19 -9.96 55.43 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 118.297 -0.858 . . . . 0.0 112.807 -178.66 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -90.36 -38.43 13.34 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 119.796 1.18 . . . . 0.0 109.056 170.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.724 HD22 HG21 ' A' ' 101' ' ' ILE . 88.6 mt -72.76 -31.82 65.2 Favored 'General case' 0 CA--C 1.517 -0.321 0 O-C-N 121.759 -0.588 . . . . 0.0 111.055 -178.347 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.2 m -61.09 -20.91 63.17 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.495 0.718 . . . . 0.0 112.108 173.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -66.95 -25.19 66.22 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.656 1.116 . . . . 0.0 110.212 174.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 41.5 mt -103.04 -61.38 1.41 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.132 0.973 . . . . 0.0 111.046 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.98 -1.22 18.94 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -172.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 37.1 m -114.91 26.47 10.13 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.6 1.091 . . . . 0.0 111.653 173.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -138.58 96.73 3.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 -172.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -58.23 -23.91 57.47 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.677 0.791 . . . . 0.0 112.501 -173.079 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -62.73 -49.59 74.43 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 121.323 0.582 . . . . 0.0 109.624 174.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.82 -40.37 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 C-N-CA 124.646 1.178 . . . . 0.0 109.51 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 31.9 mt -54.79 -43.49 72.91 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 118.574 -0.727 . . . . 0.0 111.18 -172.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -67.17 -38.15 84.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 118.693 0.679 . . . . 0.0 110.708 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLN . . . . . 0.423 ' HB3' HD11 ' A' ' 143' ' ' ILE . 62.1 mt-30 -70.17 -32.64 70.69 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.038 0.535 . . . . 0.0 110.098 -176.004 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.434 HD13 HD21 ' A' ' 99' ' ' LEU . 30.2 mt -72.78 -52.5 14.75 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 169.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.2 mt -58.59 -11.62 3.22 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.512 1.125 . . . . 0.0 113.746 -175.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 62.5 p -116.12 15.67 16.02 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.101 1.361 . . . . 0.0 110.797 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.44 95.41 0.02 OUTLIER 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.02 1.328 . . . . 0.0 110.73 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 50.7 m -82.39 -14.59 54.97 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.686 0.794 . . . . 0.0 111.099 -176.17 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.2 m -146.76 154.98 42.03 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 125.929 1.692 . . . . 0.0 106.728 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -54.88 -35.1 63.73 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.042 1.337 . . . . 0.0 111.687 178.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -53.22 -36.23 60.8 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.18 0.592 . . . . 0.0 111.988 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -64.79 -35.85 82.41 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 123.999 0.919 . . . . 0.0 112.426 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 59.3 mt -67.83 -44.12 77.95 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -75.08 -24.13 58.13 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -176.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -60.22 -44.45 95.16 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 120.736 -1.228 . . . . 0.0 109.658 171.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.423 HD11 ' HB3' ' A' ' 130' ' ' GLN . 96.6 mt -68.87 -35.53 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 C-N-CA 124.581 1.153 . . . . 0.0 109.792 -178.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.9 -49.78 72.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 122.958 0.503 . . . . 0.0 110.315 169.732 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 39.3 m -64.79 -27.19 68.72 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -168.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 18.3 mtt180 -69.56 -25.85 64.2 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.201 0.6 . . . . 0.0 111.596 175.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.865 0 C-N-CA 125.815 1.674 . . . . 0.0 111.449 -169.583 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 tpt . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 110.202 -0.295 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -66.1 109.28 2.54 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 168.782 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -54.02 -45.19 71.49 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.35 -19.22 5.08 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.913 1.685 . . . . 0.0 113.712 -178.032 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -66.64 -30.7 71.03 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-N 119.494 1.043 . . . . 0.0 111.967 176.621 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -86.56 -34.46 19.92 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.902 -0.571 . . . . 0.0 112.042 -174.137 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -90.08 104.47 8.7 Favored Pre-proline 0 N--CA 1.471 0.608 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 -173.491 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.05 -66.11 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 122.935 2.423 . . . . 0.0 113.863 -169.368 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -167.49 -64.73 0.03 OUTLIER 'General case' 0 C--O 1.231 0.127 0 C-N-CA 125.49 1.516 . . . . 0.0 109.792 178.817 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -69.18 5.76 1.15 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.156 1.382 . . . . 0.0 112.26 177.159 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.44 -29.84 71.06 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 126.116 1.767 . . . . 0.0 111.216 -174.019 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.1 mm -91.23 134.96 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.323 0 C-N-CA 125.734 1.613 . . . . 0.0 107.109 -169.781 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.4 m -157.27 151.52 24.94 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.238 0.926 . . . . 0.0 111.223 170.717 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 76.5 t -122.62 143.55 35.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 169.994 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.8 mt -140.89 147.8 22.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -170.023 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -73.55 -47.14 43.04 Favored 'General case' 0 CA--C 1.531 0.218 0 O-C-N 121.701 -0.624 . . . . 0.0 109.935 172.055 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.9 p -161.85 146.28 12.76 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -177.661 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.93 158.81 29.2 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 169.807 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.97 -43.63 86.58 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.525 0.73 . . . . 0.0 109.956 174.787 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -167.78 178.03 5.46 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 128.377 2.671 . . . . 0.0 107.452 175.067 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -57.5 -35.6 70.44 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 126.021 1.729 . . . . 0.0 113.734 176.767 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.426 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.4 mt-30 -62.32 -51.18 68.68 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 120.52 1.509 . . . . 0.0 108.308 171.772 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -59.83 -34.26 72.86 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 121.76 -0.587 . . . . 0.0 111.501 179.176 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.87 -32.67 74.49 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.584 -0.698 . . . . 0.0 110.919 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.59 -45.82 81.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 172.113 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -56.72 -42.8 79.83 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 121.624 -0.673 . . . . 0.0 110.569 176.564 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -70.31 -16.37 63.0 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.222 -0.924 . . . . 0.0 112.996 174.209 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m -79.49 -19.11 50.51 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 120.088 1.313 . . . . 0.0 110.916 169.25 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 7.9 mmt -126.36 -17.42 5.16 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 -168.615 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -59.67 -36.15 63.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 120.908 1.685 . . . . 0.0 112.03 -169.37 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.0 m -61.83 -26.81 68.35 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.839 0.745 . . . . 0.0 112.074 179.42 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.8 mt -86.25 -43.83 12.63 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.96 1.304 . . . . 0.0 108.62 177.012 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.7 tp -55.89 -41.93 75.19 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.79 0.836 . . . . 0.0 110.779 177.638 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -60.16 -30.2 69.17 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 126.199 1.8 . . . . 0.0 113.556 -174.694 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.9 mttm -111.54 20.05 17.55 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -177.262 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.341 0.7 OUTLIER 47.47 35.99 4.69 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.403 1.881 . . . . 0.0 114.911 -176.022 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.408 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 49.6 m-85 -64.51 -22.18 66.89 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.258 -0.901 . . . . 0.0 110.112 168.574 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.7 pt -146.12 165.7 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 127.303 2.241 . . . . 0.0 107.569 -177.122 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.4 p -98.5 166.86 11.16 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.3 1.04 . . . . 0.0 108.864 169.292 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -60.72 -31.38 70.67 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.283 -0.886 . . . . 0.0 111.726 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -59.46 -32.86 70.62 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 122.935 0.494 . . . . 0.0 111.626 176.966 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -59.37 -45.97 89.95 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.964 0.505 . . . . 0.0 110.329 -179.203 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.406 ' H ' HD12 ' A' ' 43' ' ' ILE . 4.3 mp -60.01 -49.79 82.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 176.559 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -68.53 -27.24 65.92 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 118.27 -0.872 . . . . 0.0 112.082 -173.636 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.71 -45.0 90.53 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 119.417 1.008 . . . . 0.0 110.557 172.697 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 25.4 mt -68.52 -46.72 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 -178.493 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.7 mttt -59.73 -47.69 84.64 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -177.432 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.13 -44.08 97.43 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 123.85 0.86 . . . . 0.0 110.846 -177.176 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 m -59.74 -48.71 80.59 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.463 0.705 . . . . 0.0 109.942 175.191 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 69.4 m . . . . . 0 CA--C 1.536 0.404 0 C-N-CA 124.141 0.976 . . . . 0.0 111.27 178.912 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.8 mm -120.97 135.24 61.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 175.552 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.73 -31.44 4.25 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 122.965 0.506 . . . . 0.0 111.854 -169.517 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.82 164.01 18.46 Favored Pre-proline 0 C--O 1.236 0.368 0 C-N-CA 125.261 1.424 . . . . 0.0 107.532 -177.64 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -45.9 115.2 0.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.306 2.671 . . . . 0.0 111.853 171.284 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.55 1.07 87.88 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-O 117.719 -1.601 . . . . 0.0 114.693 176.199 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 69.9 t -124.93 122.13 62.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 119.966 1.883 . . . . 0.0 108.572 -169.925 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.12 169.76 11.38 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.372 1.469 . . . . 0.0 109.643 176.373 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.59 ' HE2' HD12 ' A' ' 122' ' ' LEU . 4.8 ttm -139.95 59.92 14.26 Favored Pre-proline 0 CA--C 1.537 0.445 0 C-N-CA 123.761 0.824 . . . . 0.0 110.698 174.458 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -57.24 123.85 14.79 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 121.232 1.288 . . . . 0.0 109.83 -174.952 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -167.08 172.46 10.05 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.129 2.572 . . . . 0.0 108.454 174.942 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -132.94 171.09 14.42 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.079 1.352 . . . . 0.0 110.24 -174.27 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -57.03 155.36 16.17 Favored Pre-proline 0 N--CA 1.472 0.632 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.602 173.082 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -61.26 -35.67 83.63 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 121.57 1.513 . . . . 0.0 109.361 -176.784 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -67.65 -12.72 61.09 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.971 1.309 . . . . 0.0 112.437 -176.338 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 71.0 m -79.96 -3.3 47.68 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.755 0.707 . . . . 0.0 111.669 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 130.55 19.99 1.28 Allowed Glycine 0 C--N 1.337 0.626 0 CA-C-O 118.33 -1.261 . . . . 0.0 113.343 175.324 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.09 146.12 52.85 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 119.792 1.796 . . . . 0.0 109.041 169.882 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.1 mt -133.71 -28.93 1.37 Allowed 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.776 1.23 . . . . 0.0 111.045 -173.659 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.408 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 87.5 mttt -139.91 174.0 10.95 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.226 1.81 . . . . 0.0 107.749 172.904 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 95.1 m -105.92 126.44 52.18 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.353 1.061 . . . . 0.0 110.613 176.128 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.99 -176.14 41.33 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 125.865 1.698 . . . . 0.0 111.661 -177.597 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 42.1 mtt -146.66 171.3 15.32 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.762 1.625 . . . . 0.0 111.902 -176.77 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.6 m -136.4 161.72 35.05 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.56 1.944 . . . . 0.0 108.469 174.546 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.484 HD22 HD11 ' A' ' 144' ' ' ILE . 30.5 tp -142.52 103.18 4.2 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.21 1.404 . . . . 0.0 108.137 178.508 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 89.7 m -121.76 138.53 54.33 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.97 0.908 . . . . 0.0 108.732 -171.577 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.422 HD23 ' N ' ' A' ' 84' ' ' LEU . 5.1 tt -134.33 133.28 40.51 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 124.214 1.005 . . . . 0.0 108.412 179.095 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.422 ' N ' HD23 ' A' ' 83' ' ' LEU . 8.7 mp -113.51 122.14 46.37 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 126.16 1.784 . . . . 0.0 107.122 179.554 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -60.56 -40.97 93.58 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 118.931 0.787 . . . . 0.0 111.738 -178.727 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -87.54 -20.95 25.75 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 124.371 1.068 . . . . 0.0 111.414 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.5 -177.61 21.0 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 110.591 -1.003 . . . . 0.0 110.591 -168.708 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -148.56 167.54 3.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 169.241 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -120.03 95.99 4.98 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 121.756 -0.59 . . . . 0.0 110.205 -169.794 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 . . . . . 0 CA--C 1.539 0.527 0 C-N-CA 123.163 0.585 . . . . 0.0 110.392 170.834 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 N--CA 1.459 -0.557 0 CA-C-O 121.381 0.492 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 36.3 mm -112.99 139.27 39.02 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.357 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -178.266 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -116.94 -7.73 11.36 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 117.835 -1.079 . . . . 0.0 110.743 175.644 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' LEU . . . . . 0.446 HD21 HD13 ' A' ' 131' ' ' LEU . 15.4 tp -145.1 134.08 22.55 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 120.161 1.346 . . . . 0.0 110.712 -176.775 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mp -138.52 111.6 7.9 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 -169.769 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.8 mp -92.84 114.79 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 172.933 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.16 154.02 47.37 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 170.002 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.521 HD23 ' N ' ' A' ' 104' ' ' SER . 0.8 OUTLIER -143.77 150.4 38.51 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 169.741 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.521 ' N ' HD23 ' A' ' 103' ' ' LEU . 27.0 p -144.5 142.29 30.14 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 168.815 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 105' ' ' ALA . . . . . 0.578 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -150.59 132.75 15.35 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 119.395 0.998 . . . . 0.0 108.505 -179.653 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.28 -19.85 57.9 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.818 -174.176 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -140.48 154.59 46.65 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.888 0.875 . . . . 0.0 110.352 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.82 -37.46 76.45 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -178.161 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -71.85 -30.22 65.22 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.966 -1.083 . . . . 0.0 110.83 176.43 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.3 m -65.87 -36.42 83.38 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.437 169.835 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 111' ' ' HIS . . . . . 0.578 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 49.9 m-70 -59.82 -48.87 79.94 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 119.858 1.208 . . . . 0.0 109.476 170.857 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.3 mm -55.34 -54.65 22.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-N 118.703 0.683 . . . . 0.0 109.35 179.518 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.29 -39.25 96.95 Favored Glycine 0 CA--C 1.53 0.997 0 CA-C-N 118.888 0.767 . . . . 0.0 111.692 -176.183 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.428 ' CB ' HD21 ' A' ' 103' ' ' LEU . . . -65.67 -54.97 20.28 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.912 0.885 . . . . 0.0 110.373 179.007 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.6 mm -51.6 -48.24 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 C-N-CA 125.901 1.68 . . . . 0.0 108.424 177.037 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -66.79 -18.01 65.16 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.503 -0.748 . . . . 0.0 111.876 -176.524 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.86 -48.4 8.79 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 123.691 0.796 . . . . 0.0 109.369 173.823 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.426 HD21 HD12 ' A' ' 103' ' ' LEU . 3.2 pp -67.57 -23.56 65.42 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 118.24 0.473 . . . . 0.0 112.131 -178.986 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 119' ' ' SER . . . . . 0.426 ' N ' HD12 ' A' ' 118' ' ' LEU . 60.2 m -62.95 -22.91 67.13 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.863 0.865 . . . . 0.0 111.726 174.056 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -66.17 -17.46 64.74 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.945 0.793 . . . . 0.0 110.035 173.505 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 34.8 mt -108.62 -60.94 1.67 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.009 1.324 . . . . 0.0 110.119 179.456 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.59 HD12 ' HE2' ' A' ' 65' ' ' MET . 9.9 mt -62.77 -21.03 65.55 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.877 1.436 . . . . 0.0 114.877 -175.604 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 38.1 m -111.13 26.15 11.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.945 0.793 . . . . 0.0 110.826 -179.201 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -132.51 97.38 4.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.064 1.346 . . . . 0.0 107.74 178.409 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.06 -27.8 54.92 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.691 0.797 . . . . 0.0 112.456 -177.128 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -65.12 -44.55 88.34 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 123.163 0.585 . . . . 0.0 110.02 176.584 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.92 -43.31 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 174.987 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.474 HD21 ' HA ' ' A' ' 122' ' ' LEU . 55.8 mt -55.66 -43.5 76.35 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 118.58 0.627 . . . . 0.0 111.128 -174.532 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -67.37 -38.85 85.41 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.775 0.43 . . . . 0.0 110.614 178.797 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -70.03 -33.23 71.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 118.663 0.665 . . . . 0.0 109.91 -176.967 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 131' ' ' LEU . . . . . 0.446 HD13 HD21 ' A' ' 99' ' ' LEU . 32.4 mt -68.3 -56.31 9.05 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 169.834 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 40.3 mt -57.64 -12.12 2.63 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 -174.395 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 50.9 p -114.11 7.45 16.69 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.067 1.347 . . . . 0.0 111.433 179.358 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.48 110.86 1.2 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.499 1.519 . . . . 0.0 110.235 175.955 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.6 m -68.25 -28.02 66.85 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.099 0.559 . . . . 0.0 111.838 176.846 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.2 m -149.54 160.53 43.4 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.056 1.343 . . . . 0.0 108.917 -172.183 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 57.2 mp0 -54.24 -34.47 60.79 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.119 1.367 . . . . 0.0 111.408 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -53.22 -38.27 62.77 Favored 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 123.119 0.568 . . . . 0.0 112.442 -179.893 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -80.75 -27.7 36.72 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 119.024 0.829 . . . . 0.0 110.605 -178.234 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.9 mt -65.48 -50.5 65.11 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.434 1.015 . . . . 0.0 108.303 171.466 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.72 -33.94 73.66 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.123 0.969 . . . . 0.0 112.679 176.811 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -59.83 -43.45 94.56 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 118.955 0.798 . . . . 0.0 110.677 175.185 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 77.4 mt -70.5 -35.12 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 123.166 0.586 . . . . 0.0 109.716 -178.57 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 144' ' ' ILE . . . . . 0.484 HD11 HD22 ' A' ' 81' ' ' LEU . 22.3 mm -57.17 -52.37 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 169.469 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 21.4 m -65.1 -27.83 69.03 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.279 -170.808 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -59.3 -24.55 63.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.275 1.83 . . . . 0.0 113.601 174.565 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.931 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 -176.966 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.484 1.249 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -58.71 121.09 10.2 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 169.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.79 -45.42 78.48 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.7 m -52.91 -28.03 21.45 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.29 1.436 . . . . 0.0 113.701 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -58.15 -27.53 63.88 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.771 0.829 . . . . 0.0 112.343 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -92.68 -7.26 47.3 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.886 0.875 . . . . 0.0 112.851 -177.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -108.7 106.01 57.99 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 119.967 1.258 . . . . 0.0 108.568 -171.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.87 -62.22 0.12 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.598 2.199 . . . . 0.0 113.299 -173.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -174.33 -65.93 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.67 1.188 . . . . 0.0 109.182 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.1 m -73.26 2.97 6.37 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.229 1.411 . . . . 0.0 112.604 -176.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.19 -4.01 15.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 128.436 2.694 . . . . 0.0 114.289 -169.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 21.0 mt -126.55 127.12 70.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 120.332 1.423 . . . . 0.0 108.188 -168.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.9 m -143.36 145.92 33.09 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.292 1.037 . . . . 0.0 111.308 -171.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.9 t -123.85 135.69 62.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 165.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 55.9 mt -138.7 143.06 33.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 -168.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 44.4 t60 -68.18 -49.25 62.11 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.812 -0.555 . . . . 0.0 110.037 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -160.07 145.11 14.98 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.628 1.571 . . . . 0.0 107.088 171.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.5 150.37 47.24 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 167.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -60.49 -40.64 92.05 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.578 0.351 . . . . 0.0 110.832 178.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -161.46 178.25 9.31 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.248 1.419 . . . . 0.0 108.886 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -32.94 63.51 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.915 0.886 . . . . 0.0 113.057 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -76.83 -42.67 39.41 Favored 'General case' 0 C--N 1.339 0.13 0 CA-C-N 119.842 1.201 . . . . 0.0 109.499 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -64.81 -29.06 70.0 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.976 0.353 . . . . 0.0 110.602 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.73 98.25 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.373 -0.83 . . . . 0.0 111.313 173.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.7 mt -67.0 -43.52 89.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -59.14 -47.21 86.13 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.403 0.547 . . . . 0.0 111.081 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -66.19 -20.89 66.27 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.069 0.85 . . . . 0.0 112.844 176.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.9 m -79.47 -8.24 58.99 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.223 0.919 . . . . 0.0 112.181 172.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.2 mmt -131.31 -24.74 2.27 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.9 0.88 . . . . 0.0 112.731 -166.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -58.99 -36.91 64.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 119.216 0.917 . . . . 0.0 111.383 -171.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -66.54 -24.48 66.38 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.61 -0.682 . . . . 0.0 112.819 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.2 mt -85.22 -41.23 15.8 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.871 0.869 . . . . 0.0 109.118 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.0 tp -58.81 -40.29 83.68 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.096 0.958 . . . . 0.0 110.61 175.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -62.5 -26.19 68.41 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.731 1.213 . . . . 0.0 112.935 -176.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -108.08 14.73 24.89 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.367 0.667 . . . . 0.0 110.738 176.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.254 10.8 p30 45.24 41.97 6.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.361 1.865 . . . . 0.0 113.698 -172.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -64.06 -22.29 66.87 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.973 -1.079 . . . . 0.0 110.766 159.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.6 pt -143.45 163.5 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 126.301 1.84 . . . . 0.0 109.011 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.1 m -97.56 163.73 12.73 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.979 1.712 . . . . 0.0 109.274 166.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -57.51 -35.47 70.3 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.598 0.759 . . . . 0.0 112.318 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -58.9 -30.65 67.96 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.143 0.577 . . . . 0.0 112.206 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.74 -45.06 93.36 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.166 0.587 . . . . 0.0 110.244 -179.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.457 ' H ' HD12 ' A' ' 43' ' ' ILE . 4.5 mp -64.1 -47.31 90.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -64.73 -31.02 72.06 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.62 -0.705 . . . . 0.0 111.567 -174.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.55 -42.24 96.18 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.211 0.914 . . . . 0.0 111.16 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 19.1 mt -67.11 -46.27 84.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.45 -49.31 77.77 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.248 0.476 . . . . 0.0 110.079 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.93 -41.65 99.55 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 123.234 0.614 . . . . 0.0 111.011 -177.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 28.0 m -64.68 -40.93 96.25 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.692 0.397 . . . . 0.0 111.228 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 89.5 m -61.67 -44.52 96.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.866 0.866 . . . . 0.0 109.784 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 76.6 mt -65.33 -42.13 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.27 0.628 . . . . 0.0 109.647 177.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -69.94 -34.05 72.93 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -174.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -140.62 -57.39 0.52 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.424 0.556 . . . . 0.0 111.123 -169.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 153.42 172.84 22.01 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 109.269 -1.533 . . . . 0.0 109.269 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -64.0 128.95 23.07 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.258 1.972 . . . . 0.0 109.817 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -64.95 -48.35 74.36 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 122.385 0.274 . . . . 0.0 110.897 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -112.48 88.63 2.87 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -160.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.5 mm -112.62 131.1 65.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 104.945 -2.242 . . . . 0.0 104.945 169.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -116.71 -27.17 6.74 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 122.784 0.434 . . . . 0.0 111.464 -168.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.05 161.39 29.58 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 125.53 1.532 . . . . 0.0 107.158 174.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -47.91 115.63 1.57 Allowed 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.11 2.54 . . . . 0.0 111.085 170.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.52 3.66 71.43 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 117.928 -1.484 . . . . 0.0 114.508 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.1 t -129.95 127.25 63.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 119.781 1.79 . . . . 0.0 109.563 -169.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.29 168.8 17.91 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.069 1.347 . . . . 0.0 110.915 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.2 ttm -140.99 73.26 27.18 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 123.622 0.769 . . . . 0.0 110.947 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -50.38 122.68 9.85 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.991 2.46 . . . . 0.0 112.774 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -163.39 155.06 17.28 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.176 1.791 . . . . 0.0 107.471 -175.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.61 165.86 25.82 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.329 1.452 . . . . 0.0 108.077 171.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -60.63 153.25 63.23 Favored Pre-proline 0 N--CA 1.469 0.523 0 O-C-N 121.272 -0.892 . . . . 0.0 109.876 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -46.9 -46.75 17.86 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.218 2.612 . . . . 0.0 113.048 176.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -66.99 -11.05 55.79 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.601 1.16 . . . . 0.0 113.867 -177.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 80.8 m -74.39 -11.59 60.29 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.646 1.112 . . . . 0.0 112.355 172.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 136.42 24.23 0.5 Allowed Glycine 0 CA--C 1.526 0.735 0 CA-C-O 118.71 -1.05 . . . . 0.0 113.86 171.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.32 155.39 38.24 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 119.547 1.674 . . . . 0.0 109.069 168.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.8 mt -132.86 -25.78 1.82 Allowed 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.796 1.239 . . . . 0.0 111.063 -174.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -145.88 -168.72 3.06 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.652 1.981 . . . . 0.0 106.85 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 41.0 m -125.45 126.79 45.48 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.363 0.665 . . . . 0.0 109.582 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.37 -176.23 40.98 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.046 0.831 . . . . 0.0 111.73 -176.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 62.1 mtt -143.71 168.47 19.82 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.562 1.545 . . . . 0.0 111.401 -176.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.3 m -138.21 168.7 19.18 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.385 1.874 . . . . 0.0 108.478 171.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.4 tp -151.45 120.84 6.84 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.95 1.7 . . . . 0.0 107.425 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 42.4 m -136.17 129.02 31.07 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.8 tp -117.56 136.67 53.11 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 175.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.3 mp -115.48 116.15 27.72 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -59.41 -39.88 84.87 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.637 0.653 . . . . 0.0 111.621 -175.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -102.36 -2.31 29.16 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.38 0.672 . . . . 0.0 112.309 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 65.85 -175.05 18.5 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.198 0.904 . . . . 0.0 113.674 -176.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -150.59 149.03 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 167.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -86.67 119.27 26.73 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -85.91 144.31 39.06 Favored Pre-proline 0 CA--C 1.535 0.395 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 172.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -66.07 137.0 46.69 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.035 1.823 . . . . 0.0 109.936 -174.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 74.8 -7.51 20.16 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-O 118.232 -1.316 . . . . 0.0 114.219 177.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -76.3 162.36 27.98 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.933 1.867 . . . . 0.0 109.884 172.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -77.71 -26.5 50.13 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -175.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -156.47 169.25 10.84 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 124.552 1.141 . . . . 0.0 109.823 -175.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -71.27 146.8 51.94 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 CA-C-N 121.108 1.431 . . . . 0.0 111.783 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 48.4 mm -88.39 135.73 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 177.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -109.86 -25.04 10.53 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.742 0.817 . . . . 0.0 111.487 172.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 55.4 tp -127.98 126.51 41.51 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -169.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mp -133.28 139.27 46.82 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 -178.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.472 HD12 HD21 ' A' ' 122' ' ' LEU . 4.7 mt -125.49 123.62 65.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 173.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.99 155.48 36.75 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 176.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -149.99 138.73 20.85 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 176.066 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 54.3 p -139.11 155.45 47.88 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.107 1.363 . . . . 0.0 108.815 164.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.57 140.79 22.22 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.485 0.714 . . . . 0.0 109.634 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.23 -16.99 59.71 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 179.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -154.4 154.81 33.89 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.645 1.178 . . . . 0.0 109.221 -173.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.46 -35.36 73.92 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.62 0.768 . . . . 0.0 112.79 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.52 -38.55 74.28 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 119.474 1.034 . . . . 0.0 110.429 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.1 m -63.55 -38.23 90.36 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.172 0.589 . . . . 0.0 110.31 173.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -59.45 -49.23 78.62 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.096 172.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.4 mm -58.97 -46.08 91.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 119.557 1.072 . . . . 0.0 109.876 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.06 -46.64 93.45 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-N 118.846 0.748 . . . . 0.0 111.342 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.08 -46.36 89.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.419 0.688 . . . . 0.0 111.232 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.3 mm -56.62 -51.95 59.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -59.14 -33.87 71.39 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 118.782 -0.628 . . . . 0.0 111.419 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -64.92 -56.31 14.08 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.764 0.711 . . . . 0.0 110.489 173.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . 0.275 1.4 pp -71.3 -17.41 62.46 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 -174.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.5 m -60.07 -27.28 66.84 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 120.155 1.343 . . . . 0.0 111.607 170.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.08 -12.29 49.08 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.026 0.83 . . . . 0.0 111.801 175.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 69.6 mt -111.78 -51.52 2.85 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.397 1.079 . . . . 0.0 109.428 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.472 HD21 HD12 ' A' ' 101' ' ' ILE . 13.6 mt -73.45 -19.95 60.83 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -170.064 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.4 m -108.95 21.02 17.76 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.92 0.888 . . . . 0.0 110.758 -177.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -128.04 100.04 5.72 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.44 -28.62 63.49 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.687 0.795 . . . . 0.0 112.599 -175.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.31 -39.17 93.37 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.137 0.575 . . . . 0.0 110.386 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.71 -40.29 47.07 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.1 mt -57.7 -43.94 85.54 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.997 0.817 . . . . 0.0 110.615 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -57.83 -51.45 69.54 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.457 0.571 . . . . 0.0 110.05 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -65.05 -33.35 75.83 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.732 0.413 . . . . 0.0 112.087 -175.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 63.3 mt -68.06 -47.37 68.51 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 173.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.0 mt -64.22 -34.87 79.08 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 118.891 -0.576 . . . . 0.0 111.743 -176.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 63.8 p -87.49 -0.66 57.15 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.088 0.858 . . . . 0.0 112.343 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.42 118.19 5.3 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.368 0.985 . . . . 0.0 111.23 -171.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.6 m -73.05 -20.17 61.03 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.174 0.59 . . . . 0.0 112.272 -177.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.5 p -155.68 164.65 38.32 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.592 0.71 . . . . 0.0 110.832 -170.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.09 -30.94 66.64 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.786 0.834 . . . . 0.0 110.528 170.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.0 tptt -64.61 -44.01 91.94 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.47 0.577 . . . . 0.0 110.53 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -67.55 -37.95 83.43 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.258 0.481 . . . . 0.0 110.225 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 56.0 mt -60.59 -45.85 92.43 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.331 0.514 . . . . 0.0 110.357 173.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.81 92.63 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.562 0.745 . . . . 0.0 111.637 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -56.52 -42.45 78.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.759 0.709 . . . . 0.0 110.995 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 70.9 mt -66.78 -35.02 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 122.98 0.512 . . . . 0.0 109.782 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 26.4 mm -64.68 -49.55 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 119.143 0.883 . . . . 0.0 109.316 172.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 38.4 m -59.03 -30.54 68.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.102 0.865 . . . . 0.0 112.392 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -65.93 -22.1 66.47 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.272 1.029 . . . . 0.0 112.415 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.945 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 -178.845 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 tpt . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.738 0.304 . . . . 0.0 110.946 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -68.99 109.48 3.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 169.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.18 -44.29 83.43 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.351 1.06 . . . . 0.0 109.81 -172.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.07 -23.43 20.22 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.723 1.209 . . . . 0.0 112.682 -175.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -58.94 -28.41 66.23 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.776 0.716 . . . . 0.0 111.981 176.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -92.48 -13.29 30.13 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 117.911 -1.043 . . . . 0.0 112.66 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -112.67 85.33 7.36 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 120.974 1.715 . . . . 0.0 107.215 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.58 -59.52 1.16 Allowed 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 123.724 2.949 . . . . 0.0 115.464 -169.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.483 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.8 tp10 -161.62 -77.02 0.05 Allowed 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 118.677 0.672 . . . . 0.0 112.271 -178.394 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -68.61 13.62 0.09 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.109 1.764 . . . . 0.0 111.843 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 9' ' ' GLU . 5.5 m -75.65 8.7 2.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 128.508 2.723 . . . . 0.0 113.452 -168.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.4 mm -135.82 134.73 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 104.491 -2.411 . . . . 0.0 104.491 -169.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 75.7 m -155.33 147.31 23.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 118.83 0.741 . . . . 0.0 110.454 174.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 77.4 t -124.06 136.19 61.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 103.866 -2.642 . . . . 0.0 103.866 169.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 37.6 mt -139.0 147.86 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 N-CA-C 105.159 -2.163 . . . . 0.0 105.159 -169.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -66.87 -42.69 85.19 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.389 -0.819 . . . . 0.0 110.714 175.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -167.4 145.7 4.81 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.41 155.19 36.63 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -60.26 -40.12 89.21 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 176.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -167.84 -177.06 3.29 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 128.019 2.528 . . . . 0.0 107.521 172.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -61.76 -33.78 74.69 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 177.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.484 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.7 mt-30 -59.75 -51.48 69.58 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.621 1.555 . . . . 0.0 107.433 172.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -60.57 -34.55 74.35 Favored 'General case' 0 C--O 1.223 -0.337 0 O-C-N 121.646 -0.659 . . . . 0.0 111.521 177.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.5 73.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.629 -0.67 . . . . 0.0 110.883 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.94 -47.47 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 171.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.68 -45.45 81.74 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.743 -0.598 . . . . 0.0 110.557 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -68.57 -17.46 64.14 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 118.048 -0.977 . . . . 0.0 112.64 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.9 m -80.25 -17.61 51.74 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 120.866 1.666 . . . . 0.0 111.87 169.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.8 mmt -125.0 -18.44 5.49 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -169.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.4 -36.23 62.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-N 120.437 1.471 . . . . 0.0 111.734 -169.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.8 m -63.15 -22.34 66.8 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.757 0.708 . . . . 0.0 112.269 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 80.7 mt -89.91 -41.68 11.65 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.24 1.016 . . . . 0.0 109.125 174.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -55.36 -42.15 73.52 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.61 0.764 . . . . 0.0 110.576 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.75 -24.26 66.19 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 125.816 1.646 . . . . 0.0 114.102 -171.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -111.01 21.96 15.84 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.029 0.377 . . . . 0.0 110.422 172.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 54.84 34.19 21.46 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.996 1.318 . . . . 0.0 113.166 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -68.37 -22.12 64.68 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 120.583 -1.323 . . . . 0.0 109.71 168.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.1 pt -142.2 174.69 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 126.74 2.016 . . . . 0.0 108.557 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 m -112.24 159.9 18.15 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 126.471 1.908 . . . . 0.0 107.813 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.2 -31.22 69.95 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.24 -0.913 . . . . 0.0 112.337 -174.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -58.09 -32.48 68.11 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.052 0.541 . . . . 0.0 112.004 175.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -61.13 -44.13 97.81 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.358 0.663 . . . . 0.0 110.48 -177.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.406 ' H ' HD12 ' A' ' 43' ' ' ILE . 4.2 mp -59.17 -50.13 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 174.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -69.37 -25.01 63.96 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.437 -0.792 . . . . 0.0 112.142 -175.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.56 98.99 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 119.699 1.136 . . . . 0.0 110.627 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.0 mt -68.4 -45.53 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.484 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.3 mttt -60.73 -41.08 94.61 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.382 0.537 . . . . 0.0 110.096 -178.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -65.15 -38.76 91.62 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.892 0.877 . . . . 0.0 111.41 177.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -63.05 -36.7 84.44 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.652 -0.655 . . . . 0.0 110.376 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.6 m -67.47 -36.98 82.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.04 0.936 . . . . 0.0 110.664 176.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 86.9 mt -64.65 -42.34 94.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 119.171 0.896 . . . . 0.0 109.578 172.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -64.52 -34.4 78.15 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.468 0.707 . . . . 0.0 112.329 -172.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -150.25 -51.05 0.14 Allowed 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 123.229 0.612 . . . . 0.0 111.253 -169.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.28 -179.46 22.36 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 109.028 -1.629 . . . . 0.0 109.028 -173.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -42.0 117.8 0.82 Allowed 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.845 3.03 . . . . 0.0 112.634 171.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -77.99 -14.0 59.68 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.626 176.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -136.55 103.0 5.1 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.517 1.127 . . . . 0.0 108.162 -169.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.2 mm -138.59 140.88 38.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mp -132.58 -27.91 1.68 Allowed 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -169.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.2 160.88 24.22 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.77 114.42 1.36 Allowed 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.728 2.285 . . . . 0.0 111.15 174.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.39 12.5 72.85 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 118.137 -1.368 . . . . 0.0 114.19 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.86 127.15 63.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-N 119.722 1.761 . . . . 0.0 108.827 -174.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.71 169.46 12.52 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.61 1.564 . . . . 0.0 109.809 179.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.418 ' CE ' HD13 ' A' ' 118' ' ' LEU . 14.5 ttm -143.51 67.98 16.69 Favored Pre-proline 0 CA--C 1.536 0.436 0 O-C-N 121.926 -0.484 . . . . 0.0 111.295 176.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.06 149.4 53.27 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 121.297 1.331 . . . . 0.0 113.066 -174.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 174.15 153.44 0.11 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 128.582 2.753 . . . . 0.0 106.28 -169.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.85 166.1 24.09 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 125.988 1.715 . . . . 0.0 106.903 172.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -52.71 147.86 14.36 Favored Pre-proline 0 CA--C 1.536 0.421 0 CA-C-O 118.526 -0.749 . . . . 0.0 109.352 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -47.44 -42.13 28.65 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.794 2.33 . . . . 0.0 112.281 174.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -62.77 -13.8 37.37 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.491 1.116 . . . . 0.0 113.712 -177.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 71.6 m -78.28 -0.68 29.69 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.857 0.753 . . . . 0.0 111.827 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.54 15.03 2.26 Favored Glycine 0 C--N 1.336 0.53 0 CA-C-O 118.32 -1.267 . . . . 0.0 112.929 171.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.33 147.96 52.54 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 119.42 1.61 . . . . 0.0 109.549 169.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.1 mt -131.32 -33.5 1.48 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.519 1.128 . . . . 0.0 110.402 -174.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -145.5 156.69 43.87 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.516 1.527 . . . . 0.0 108.104 177.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.9 m -90.14 132.68 35.32 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 122.984 0.514 . . . . 0.0 110.365 -176.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.01 -176.17 43.08 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.739 1.161 . . . . 0.0 110.8 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 46.9 mtt -148.9 170.87 17.32 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.552 1.941 . . . . 0.0 110.284 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.42 162.67 40.12 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.085 1.754 . . . . 0.0 108.339 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.1 tp -146.42 122.45 10.74 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 126.207 1.803 . . . . 0.0 108.338 -172.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 74.2 m -137.25 143.79 42.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.373 1.069 . . . . 0.0 108.522 -171.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.2 tt -141.81 131.65 24.35 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 177.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -107.25 118.08 35.77 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 126.769 2.027 . . . . 0.0 107.018 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -59.49 -34.73 72.94 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.985 0.812 . . . . 0.0 112.45 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -96.67 -10.6 26.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.03 0.932 . . . . 0.0 112.097 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.73 179.97 11.88 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -169.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -149.23 161.38 5.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 169.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -109.02 118.02 35.72 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -169.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -79.84 153.67 75.4 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 123.798 0.839 . . . . 0.0 109.65 174.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -78.94 -3.68 13.39 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 123.379 2.719 . . . . 0.0 115.417 -169.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -150.49 35.51 0.95 Allowed Glycine 0 C--N 1.339 0.695 0 CA-C-N 119.357 0.981 . . . . 0.0 112.532 -172.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -135.78 154.18 51.3 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 171.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -65.97 -30.5 71.07 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -169.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -139.05 161.76 56.12 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.696 0.798 . . . . 0.0 111.834 -172.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.87 143.32 32.99 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 122.629 2.219 . . . . 0.0 110.204 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 30.6 mm -85.9 135.43 25.01 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -110.04 -16.35 13.83 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.379 -1.296 . . . . 0.0 111.069 172.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 40.7 tp -147.79 135.04 20.53 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 120.409 1.459 . . . . 0.0 110.429 -169.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.7 mp -138.99 136.99 35.96 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.307 1.043 . . . . 0.0 109.061 -172.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 4.0 mt -116.72 115.42 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.051 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 168.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.81 152.52 40.83 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 171.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.494 HD23 ' N ' ' A' ' 104' ' ' SER . 0.5 OUTLIER -144.32 137.83 27.45 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 104.856 -2.276 . . . . 0.0 104.856 169.703 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.494 ' N ' HD23 ' A' ' 103' ' ' LEU . 92.1 p -129.99 148.03 51.8 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.047 1.739 . . . . 0.0 107.412 169.159 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.84 136.6 23.13 Favored 'General case' 0 CA--C 1.513 -0.474 0 O-C-N 121.625 -0.672 . . . . 0.0 109.671 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.22 -21.35 60.66 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 123.525 0.515 . . . . 0.0 111.628 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -143.92 153.0 41.84 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.863 0.865 . . . . 0.0 109.738 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.43 -33.37 71.17 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -77.61 -31.04 52.64 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.306 0.957 . . . . 0.0 111.236 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.5 m -63.53 -37.99 89.42 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.901 -0.499 . . . . 0.0 109.701 169.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -47.7 84.37 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.191 0.996 . . . . 0.0 110.219 171.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.0 mm -58.38 -50.62 78.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.03 -39.2 93.99 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-N 119.115 0.871 . . . . 0.0 111.93 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.12 -52.66 32.31 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.567 1.147 . . . . 0.0 110.567 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.0 mm -50.81 -47.34 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 125.508 1.523 . . . . 0.0 108.671 173.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -66.55 -9.45 35.1 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.974 -1.079 . . . . 0.0 112.542 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -93.87 -48.5 6.25 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 124.204 1.002 . . . . 0.0 109.626 169.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.548 HD12 ' N ' ' A' ' 119' ' ' SER . 1.1 pp -72.39 -24.38 61.24 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 113.313 0.856 . . . . 0.0 113.313 -173.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.548 ' N ' HD12 ' A' ' 118' ' ' LEU . 10.3 p -66.11 -21.69 66.36 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 123.124 0.57 . . . . 0.0 111.457 172.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -67.0 -21.25 65.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.246 0.93 . . . . 0.0 109.849 172.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 24.8 mt -96.82 -71.21 0.69 Allowed 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.12 0.968 . . . . 0.0 110.783 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 20.0 mt -69.06 -13.33 62.38 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 -169.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 31.2 m -100.22 27.26 5.77 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 120.243 1.383 . . . . 0.0 111.522 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -128.88 110.46 12.14 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.625 1.97 . . . . 0.0 106.104 172.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -60.24 -26.63 66.59 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.863 0.465 . . . . 0.0 111.453 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -62.93 -47.49 82.99 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 123.619 0.768 . . . . 0.0 109.676 175.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -65.52 -44.16 94.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 123.982 0.913 . . . . 0.0 109.092 176.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 48.2 mt -56.12 -43.39 78.12 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 118.632 0.651 . . . . 0.0 111.487 -175.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -67.74 -40.47 84.15 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 118.052 0.387 . . . . 0.0 110.462 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.424 ' HB3' HD11 ' A' ' 143' ' ' ILE . 44.0 mt-30 -69.64 -33.08 72.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 118.749 0.704 . . . . 0.0 110.214 -176.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 19.1 mt -68.3 -56.77 7.43 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 170.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 35.7 mt -55.41 -26.22 40.47 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -173.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 74.4 p -101.57 6.78 42.31 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.402 1.081 . . . . 0.0 112.338 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.31 112.7 1.65 Allowed 'General case' 0 C--N 1.342 0.264 0 C-N-CA 124.845 1.258 . . . . 0.0 110.493 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 7.4 m -70.0 -24.81 63.36 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.253 0.621 . . . . 0.0 112.054 177.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 15.5 m -150.59 158.97 44.77 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.111 0.964 . . . . 0.0 110.16 -169.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -51.15 -39.34 56.08 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.949 1.7 . . . . 0.0 111.1 176.117 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -57.25 -35.36 69.63 Favored 'General case' 0 C--O 1.227 -0.103 0 C-N-CA 123.13 0.572 . . . . 0.0 112.384 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -80.44 -27.71 37.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 119.426 1.012 . . . . 0.0 110.413 -177.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 27.4 mt -66.15 -50.44 63.93 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.526 1.057 . . . . 0.0 108.387 170.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.12 -33.75 67.68 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.934 0.894 . . . . 0.0 113.15 174.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.76 -42.53 99.73 Favored 'General case' 0 N--CA 1.463 0.177 0 O-C-N 121.209 -0.932 . . . . 0.0 110.868 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.424 HD11 ' HB3' ' A' ' 130' ' ' GLN . 96.6 mt -69.15 -35.41 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.1 mm -58.26 -53.82 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 169.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 24.7 m -63.96 -27.0 68.84 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 122.68 0.392 . . . . 0.0 111.578 -170.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -59.82 -27.38 66.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.663 1.585 . . . . 0.0 113.404 175.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.851 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 -174.64 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.486 1.354 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -67.05 112.39 4.36 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 104.873 -2.269 . . . . 0.0 104.873 168.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -48.53 -43.51 35.43 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.983 0.913 . . . . 0.0 110.377 -176.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.42 -24.36 1.94 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.685 1.994 . . . . 0.0 113.902 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -59.42 -26.85 65.51 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.291 0.951 . . . . 0.0 112.337 177.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -100.44 -15.86 17.77 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.098 0.959 . . . . 0.0 112.902 -174.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -103.09 98.32 11.52 Favored Pre-proline 0 N--CA 1.471 0.624 0 CA-C-N 120.879 1.672 . . . . 0.0 106.985 -173.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.5 -60.43 0.31 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.696 2.264 . . . . 0.0 113.434 -171.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.408 ' C ' ' H ' ' A' ' 11' ' ' SER . 54.9 tt0 -165.97 -87.02 0.02 OUTLIER 'General case' 0 C--O 1.232 0.157 0 C-N-CA 123.592 0.757 . . . . 0.0 111.621 -170.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.2 m -67.87 8.76 0.35 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.337 1.455 . . . . 0.0 111.754 176.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.408 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -65.63 -25.54 67.42 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.99 1.316 . . . . 0.0 111.905 -174.926 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.2 mp -98.23 140.0 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.975 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.0 m -154.39 158.36 39.91 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.483 0.659 . . . . 0.0 110.606 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.5 t -128.33 145.46 35.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 173.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mm -138.76 140.04 39.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 104.654 -2.351 . . . . 0.0 104.654 -169.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -71.34 -49.52 41.63 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 119.269 0.941 . . . . 0.0 109.303 171.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.0 p -159.4 144.24 15.48 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.5 156.87 25.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 169.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.7 ttpt -58.75 -42.07 87.99 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.878 0.471 . . . . 0.0 110.653 175.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -165.22 177.69 7.46 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 128.212 2.605 . . . . 0.0 107.214 173.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.81 -37.07 65.65 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.227 1.811 . . . . 0.0 114.036 175.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.403 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.6 mt-30 -62.6 -50.35 71.6 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 120.401 1.455 . . . . 0.0 108.687 173.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -60.55 -32.45 71.52 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 122.951 0.5 . . . . 0.0 111.416 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.36 -37.86 86.27 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 121.575 -0.703 . . . . 0.0 110.158 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.51 -47.28 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 170.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -58.03 -49.64 76.15 Favored 'General case' 0 C--N 1.334 -0.082 0 C-N-CA 123.222 0.609 . . . . 0.0 110.657 -174.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -62.82 -28.69 70.18 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.568 1.147 . . . . 0.0 111.626 174.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.2 m -76.51 -15.18 59.94 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.718 1.145 . . . . 0.0 112.766 177.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.94 -12.49 4.7 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -171.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -55.75 -34.19 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 120.525 1.511 . . . . 0.0 112.069 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.9 m -66.84 -41.61 87.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.385 -0.822 . . . . 0.0 110.253 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -65.74 -38.45 89.15 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 46.2 tp -60.65 -49.86 75.82 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.534 0.734 . . . . 0.0 110.316 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -64.92 -33.2 75.45 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.398 1.079 . . . . 0.0 112.221 -176.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -79.86 -0.37 34.47 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.654 1.182 . . . . 0.0 111.876 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 53.82 32.07 14.29 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.24 1.816 . . . . 0.0 113.284 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -68.31 -24.88 64.89 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 120.819 -1.175 . . . . 0.0 109.709 168.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.6 pt -144.07 168.72 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 126.235 1.814 . . . . 0.0 110.016 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.3 p -96.11 172.56 7.91 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.807 1.243 . . . . 0.0 109.845 169.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.27 -33.05 74.49 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.267 -0.896 . . . . 0.0 110.557 171.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -61.27 -40.25 93.41 Favored 'General case' 0 C--N 1.342 0.251 0 O-C-N 121.97 -0.456 . . . . 0.0 110.684 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -54.28 -49.48 69.49 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.009 0.524 . . . . 0.0 110.154 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 45.2 mt -59.72 -49.2 84.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 C-N-CA 123.644 0.778 . . . . 0.0 109.246 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -68.5 -26.87 65.68 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.165 -0.921 . . . . 0.0 111.995 -174.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.95 83.29 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.566 1.076 . . . . 0.0 110.683 171.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.06 -51.72 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.403 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.9 mttt -58.52 -44.03 89.36 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -175.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -64.28 -46.24 84.54 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.774 0.83 . . . . 0.0 111.275 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.0 m -64.05 -35.79 81.88 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.801 0.44 . . . . 0.0 110.76 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 96.8 m -63.31 -46.38 86.94 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.746 0.818 . . . . 0.0 109.827 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.03 -45.94 95.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 118.632 0.651 . . . . 0.0 109.698 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -71.69 -32.74 68.16 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -170.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -138.62 -56.46 0.63 Allowed 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.152 0.581 . . . . 0.0 111.058 -168.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 155.54 167.41 17.04 Favored Glycine 0 CA--C 1.531 1.071 0 N-CA-C 109.644 -1.383 . . . . 0.0 109.644 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -44.99 138.91 8.54 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.647 2.898 . . . . 0.0 112.79 176.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -52.17 -37.39 54.49 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.077 0.951 . . . . 0.0 112.827 -175.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -150.65 156.1 40.68 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 26.3 mm -137.04 140.03 43.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 102.643 -3.095 . . . . 0.0 102.643 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.586 HD12 HG12 ' A' ' 63' ' ' VAL . 30.7 mt -110.39 -40.46 4.64 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -168.224 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -168.38 165.03 7.82 Favored Pre-proline 0 C--O 1.236 0.384 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -169.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -47.92 113.03 0.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.827 2.351 . . . . 0.0 110.756 169.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.16 5.78 75.99 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 117.81 -1.55 . . . . 0.0 114.848 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.586 HG12 HD12 ' A' ' 59' ' ' LEU . 19.0 t -135.3 133.95 52.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-N 120.92 2.36 . . . . 0.0 109.524 -171.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.65 166.77 21.84 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.786 1.635 . . . . 0.0 110.281 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.525 ' HB2' HD11 ' A' ' 59' ' ' LEU . 33.5 ttp -147.5 82.44 8.13 Favored Pre-proline 0 C--O 1.225 -0.195 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 170.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -58.76 -91.21 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.312 0 C-N-CA 123.036 2.491 . . . . 0.0 114.43 -174.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . 0.301 0.2 OUTLIER 47.78 178.18 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.578 2.351 . . . . 0.0 114.753 -168.983 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.7 167.94 19.92 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 125.281 1.432 . . . . 0.0 107.848 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 25.1 mtm105 -60.74 150.57 75.61 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-O 118.575 -0.726 . . . . 0.0 109.046 174.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -45.63 -45.14 16.73 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.634 2.889 . . . . 0.0 112.755 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -61.71 -15.55 41.48 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.219 1.408 . . . . 0.0 113.643 -176.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.5 m -79.63 -4.72 52.91 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.518 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 131.49 18.64 1.27 Allowed Glycine 0 CA--C 1.523 0.579 0 CA-C-O 118.943 -0.92 . . . . 0.0 113.591 174.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.0 144.2 56.34 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 119.087 1.443 . . . . 0.0 107.645 169.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.9 mt -123.69 -32.63 3.3 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 124.313 1.045 . . . . 0.0 110.158 -173.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -143.19 170.85 14.97 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.415 1.886 . . . . 0.0 107.468 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 97.5 m -103.17 122.23 44.28 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.464 0.706 . . . . 0.0 110.381 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.11 -177.23 38.65 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 126.017 1.77 . . . . 0.0 111.052 -175.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.607 ' SD ' HD21 ' A' ' 118' ' ' LEU . 51.4 mtt -149.15 169.83 19.82 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.594 1.697 . . . . 0.0 112.065 -171.332 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.9 p -146.86 168.08 22.32 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.859 1.264 . . . . 0.0 109.793 174.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.555 HD22 HD11 ' A' ' 144' ' ' ILE . 24.5 tp -153.98 106.78 2.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.797 1.639 . . . . 0.0 106.795 -172.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 65.5 m -122.7 140.9 52.36 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 123.79 0.836 . . . . 0.0 108.77 -169.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.4 tt -133.67 130.47 38.26 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.3 mp -110.32 119.45 39.28 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.744 1.617 . . . . 0.0 107.924 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -63.1 -36.15 82.62 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.588 0.631 . . . . 0.0 112.178 -177.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -91.05 -17.1 26.79 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.811 1.245 . . . . 0.0 111.919 177.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 68.1 -179.93 18.18 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -168.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.74 162.94 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 169.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -121.09 83.82 2.14 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 122.295 1.045 . . . . 0.0 110.605 -169.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -50.71 143.96 13.74 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 114.317 -1.31 . . . . 0.0 112.212 174.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -67.94 152.78 76.63 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.107 1.871 . . . . 0.0 109.945 169.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.9 -44.37 2.32 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 125.316 1.436 . . . . 0.0 112.422 176.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.18 140.67 31.7 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.895 2.078 . . . . 0.0 110.55 169.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -73.73 -41.63 62.28 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -169.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -146.52 151.72 43.88 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 124.737 1.215 . . . . 0.0 110.194 -175.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -61.94 155.15 56.9 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.155 2.57 . . . . 0.0 112.593 -169.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 47.5 mm -112.43 136.95 47.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 C-N-CA 124.735 1.214 . . . . 0.0 107.876 -171.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -113.74 -9.71 13.12 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 117.192 -1.385 . . . . 0.0 110.973 175.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.9 mt -136.37 138.94 42.12 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 120.582 1.537 . . . . 0.0 111.309 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.5 mp -137.02 101.46 4.57 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.428 HG21 HD22 ' A' ' 118' ' ' LEU . 1.7 mp -77.05 146.43 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 169.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.06 23.68 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 109.035 -1.626 . . . . 0.0 109.035 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.519 HD23 ' N ' ' A' ' 104' ' ' SER . 1.1 tt -155.04 150.0 26.79 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 -171.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.519 ' N ' HD23 ' A' ' 103' ' ' LEU . 11.0 p -143.0 141.95 31.48 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 127.226 2.211 . . . . 0.0 105.084 169.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -149.23 130.22 14.37 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -173.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.29 -22.96 57.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 123.399 0.437 . . . . 0.0 111.428 -175.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -139.41 155.76 47.42 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.778 0.831 . . . . 0.0 110.32 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.87 -34.24 71.4 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.684 0.793 . . . . 0.0 112.973 -177.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -77.28 -32.16 55.34 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.1 0.864 . . . . 0.0 111.102 177.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.3 m -60.48 -41.7 94.78 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 169.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.36 -47.3 84.24 Favored 'General case' 0 C--O 1.225 -0.21 0 C-N-CA 124.68 1.192 . . . . 0.0 110.71 173.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 15.1 mm -59.69 -53.03 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -63.14 -37.04 94.27 Favored Glycine 0 CA--C 1.528 0.891 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 -177.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.432 ' CB ' HD21 ' A' ' 103' ' ' LEU . . . -66.0 -50.77 63.11 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.641 1.177 . . . . 0.0 110.53 177.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 mm -54.71 -45.54 73.19 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -71.28 -10.32 59.56 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.674 0.79 . . . . 0.0 113.056 -177.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.23 -42.5 14.62 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 169.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.607 HD21 ' SD ' ' A' ' 79' ' ' MET . 83.8 mt -63.77 -32.99 74.67 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 117.804 -1.093 . . . . 0.0 110.2 178.43 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 13.8 m -51.17 -28.88 12.23 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 171.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -67.9 -22.82 65.06 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.634 1.106 . . . . 0.0 110.845 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 49.6 mt -108.03 -60.81 1.67 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.744 1.218 . . . . 0.0 109.874 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.498 HD13 HD13 ' A' ' 59' ' ' LEU . 0.1 OUTLIER -52.14 -38.73 58.48 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 127.679 2.392 . . . . 0.0 114.19 178.098 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 56.5 m -95.06 24.99 4.45 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.481 1.037 . . . . 0.0 111.664 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -133.32 101.91 5.35 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 124.101 0.96 . . . . 0.0 108.808 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -58.16 -28.55 64.83 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.801 -179.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.35 -43.15 91.75 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.278 0.631 . . . . 0.0 110.049 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.56 -44.4 86.44 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.8 mt -56.29 -37.88 70.47 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 119.101 0.864 . . . . 0.0 111.319 -176.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -68.35 -40.33 81.57 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 118.907 0.776 . . . . 0.0 111.109 175.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -69.03 -34.76 75.75 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 118.797 0.726 . . . . 0.0 109.805 -177.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -65.96 -55.15 18.3 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 169.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 35.0 mt -56.19 -16.11 4.79 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.901 1.075 . . . . 0.0 113.901 -176.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 42.8 p -112.0 7.62 19.91 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.95 1.3 . . . . 0.0 110.806 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.49 117.78 6.16 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.631 1.572 . . . . 0.0 110.348 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 19.8 m -76.99 -15.36 59.66 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.721 0.808 . . . . 0.0 112.157 175.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 73.5 p -154.92 164.65 38.56 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 119.035 0.834 . . . . 0.0 110.986 -170.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -58.09 -37.11 73.88 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.856 0.862 . . . . 0.0 109.494 169.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -57.91 -45.53 86.35 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 122.659 0.384 . . . . 0.0 110.455 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.68 -33.87 76.9 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.3 mt -67.55 -51.49 50.14 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.065 0.848 . . . . 0.0 109.074 175.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.72 -24.4 67.76 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.096 0.958 . . . . 0.0 113.511 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -61.07 -44.67 97.02 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 120.712 -1.243 . . . . 0.0 109.776 172.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 89.9 mt -67.35 -35.51 73.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.166 0.986 . . . . 0.0 109.368 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ILE . . . . . 0.555 HD11 HD22 ' A' ' 81' ' ' LEU . 41.2 mm -56.22 -53.77 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 169.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 20.3 m -64.66 -33.02 74.95 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 123.642 0.589 . . . . 0.0 110.624 -171.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -58.51 -45.06 89.55 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.779 1.631 . . . . 0.0 112.707 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.038 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 -169.785 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 tpt . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -65.91 110.11 2.76 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 168.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.38 -41.11 65.58 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.618 0.767 . . . . 0.0 110.447 -175.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.4 p -53.26 -21.62 5.68 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.583 1.553 . . . . 0.0 113.549 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -59.82 -25.0 64.61 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.664 1.12 . . . . 0.0 112.264 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -100.72 -10.97 20.33 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 117.57 -1.205 . . . . 0.0 113.126 -174.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -113.78 83.32 7.3 Favored Pre-proline 0 N--CA 1.474 0.768 0 CA-C-N 121.52 1.964 . . . . 0.0 107.479 -174.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -55.74 -54.18 4.53 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.864 3.042 . . . . 0.0 116.277 -169.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.466 ' C ' ' H ' ' A' ' 11' ' ' SER . 42.0 tt0 -157.88 -93.34 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.573 0.624 . . . . 0.0 112.589 -169.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 m -68.52 13.43 0.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.432 1.493 . . . . 0.0 111.365 177.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.466 ' H ' ' C ' ' A' ' 9' ' ' GLU . 11.2 m -62.03 -29.17 70.1 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.448 1.499 . . . . 0.0 111.229 -169.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.3 mp -105.84 129.93 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 -175.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 31.1 m -144.2 141.56 29.97 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 123.388 0.43 . . . . 0.0 110.351 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.4 t -112.6 135.41 52.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 169.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.41 HG22 ' H ' ' A' ' 17' ' ' SER . 30.9 mt -136.75 145.52 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -169.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -59.4 -46.29 89.11 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.99 0.916 . . . . 0.0 111.82 174.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 15' ' ' ILE . 18.5 p -168.14 150.94 5.56 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.541 1.136 . . . . 0.0 108.161 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.21 144.26 30.8 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 168.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tppt? -72.32 -30.01 64.36 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 122.096 -0.378 . . . . 0.0 111.955 -175.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -163.81 173.18 13.1 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 127.388 2.275 . . . . 0.0 106.123 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -66.6 -33.95 76.8 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 119.252 -0.404 . . . . 0.0 110.504 169.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.412 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.4 mt-30 -59.06 -48.03 83.09 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 169.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -65.54 -33.56 76.21 Favored 'General case' 0 C--O 1.223 -0.292 0 O-C-N 121.788 -0.57 . . . . 0.0 111.52 -178.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.61 -37.77 88.6 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 121.81 -0.556 . . . . 0.0 109.686 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.1 -45.85 85.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.022 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -56.87 -44.95 82.75 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.035 0.534 . . . . 0.0 110.426 -174.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -67.62 -32.79 73.75 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 118.101 -0.952 . . . . 0.0 111.734 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.3 m -61.99 -21.16 64.61 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.64 1.109 . . . . 0.0 112.274 173.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.6 mmt -122.2 -23.94 5.2 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 -169.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -59.5 -34.57 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 120.912 1.687 . . . . 0.0 112.272 -170.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.1 m -63.1 -29.64 70.96 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.34 0.973 . . . . 0.0 111.723 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 71.5 mt -81.07 -40.66 23.8 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.153 0.981 . . . . 0.0 109.265 174.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.5 tp -56.58 -40.71 75.7 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.711 0.804 . . . . 0.0 110.628 177.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -66.54 -27.96 68.16 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 124.918 1.287 . . . . 0.0 113.068 -172.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -101.87 16.95 24.35 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 117.971 0.351 . . . . 0.0 110.486 173.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.423 0.0 OUTLIER 44.28 42.66 5.36 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.26 2.224 . . . . 0.0 115.807 -170.122 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -68.14 -19.29 64.81 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 120.974 -1.079 . . . . 0.0 110.193 168.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.9 pt -143.26 174.14 5.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 127.081 2.152 . . . . 0.0 108.125 -176.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 m -111.75 159.22 18.47 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.007 1.723 . . . . 0.0 107.722 171.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -60.99 -30.65 70.4 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.971 -1.08 . . . . 0.0 111.901 -176.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -57.97 -36.73 73.0 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.705 -0.622 . . . . 0.0 111.92 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -60.3 -45.11 94.51 Favored 'General case' 0 CA--C 1.527 0.09 0 C-N-CA 123.681 0.792 . . . . 0.0 110.015 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.8 mt -59.1 -51.05 77.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 124.725 1.21 . . . . 0.0 108.481 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.8 tp60 -67.97 -26.0 65.71 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.026 -0.988 . . . . 0.0 111.775 -175.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.33 -43.36 96.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 119.771 1.168 . . . . 0.0 110.658 173.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.2 mt -67.74 -48.81 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.4 mttt -59.34 -45.5 91.19 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.195 0.452 . . . . 0.0 109.841 -175.717 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.3 -42.78 96.21 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 124.222 1.009 . . . . 0.0 111.106 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.0 m -64.36 -42.9 95.97 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.135 0.425 . . . . 0.0 110.235 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 98.3 m -58.79 -44.01 90.61 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.573 1.149 . . . . 0.0 111.022 176.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 65.8 mt -68.35 -40.27 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 123.753 0.821 . . . . 0.0 109.979 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -64.37 -34.67 78.7 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.838 0.855 . . . . 0.0 113.019 -173.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -146.41 -54.02 0.25 Allowed 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 122.87 0.468 . . . . 0.0 111.149 -168.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 160.61 168.13 22.09 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -47.09 145.34 7.6 Favored 'Trans proline' 0 N--CA 1.459 -0.548 0 C-N-CA 123.203 2.602 . . . . 0.0 113.19 173.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -103.73 -8.58 19.76 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.979 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -142.59 83.3 1.81 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.41 1.084 . . . . 0.0 108.376 -169.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.3 mm -125.65 127.02 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 103.713 -2.699 . . . . 0.0 103.713 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.9 mp -120.15 -21.99 6.8 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -169.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.56 159.36 31.72 Favored Pre-proline 0 C--O 1.236 0.368 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 170.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -62.24 104.83 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 121.682 1.588 . . . . 0.0 108.99 170.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.56 -10.04 16.68 Favored Glycine 0 CA--C 1.533 1.176 0 CA-C-O 117.958 -1.468 . . . . 0.0 113.973 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.8 t -132.91 123.06 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 119.632 1.716 . . . . 0.0 108.863 -170.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -117.73 167.17 11.61 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 126.114 1.766 . . . . 0.0 109.12 174.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.9 ttm -137.58 60.25 24.68 Favored Pre-proline 0 CA--C 1.548 0.888 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 177.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -53.53 141.79 61.63 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.262 1.975 . . . . 0.0 114.429 -172.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -175.75 156.66 1.88 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.552 2.741 . . . . 0.0 106.753 -171.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.62 162.03 33.86 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.863 1.665 . . . . 0.0 107.366 169.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -52.52 141.94 32.62 Favored Pre-proline 0 CA--C 1.537 0.454 0 CA-C-O 117.676 -1.154 . . . . 0.0 108.868 176.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -45.69 -41.13 19.29 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.818 3.012 . . . . 0.0 112.916 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -62.2 -13.06 23.73 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.465 1.506 . . . . 0.0 113.253 -177.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 62.1 m -78.25 -1.82 34.85 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.649 0.78 . . . . 0.0 111.583 177.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.41 17.46 2.4 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-O 118.433 -1.204 . . . . 0.0 112.96 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.58 145.83 55.58 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.3 1.55 . . . . 0.0 108.724 169.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.1 mt -128.46 -32.28 2.2 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 124.471 1.109 . . . . 0.0 110.425 -173.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -145.26 160.86 40.84 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.605 1.562 . . . . 0.0 108.438 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 82.2 m -94.54 127.76 40.7 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 123.195 0.598 . . . . 0.0 110.091 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -170.82 -176.45 40.12 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 125.204 1.383 . . . . 0.0 110.683 -175.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 49.2 mtt -148.26 171.81 15.36 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.095 1.758 . . . . 0.0 111.059 -174.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -139.15 168.25 20.25 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.131 1.773 . . . . 0.0 108.586 174.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.477 HD22 HD11 ' A' ' 144' ' ' ILE . 13.3 tp -148.77 83.31 1.46 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.699 2.0 . . . . 0.0 107.397 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 55.7 m -86.51 142.57 28.25 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 176.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.2 tt -136.59 116.9 13.58 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 169.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -89.1 132.24 34.89 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 172.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.06 -29.24 70.12 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 169.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -130.29 75.66 1.67 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.645 1.978 . . . . 0.0 107.331 -178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -52.12 161.45 2.17 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 125.949 1.738 . . . . 0.0 113.835 175.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 48.9 t -127.6 147.58 32.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 C-N-CA 125.745 1.618 . . . . 0.0 107.426 -173.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -98.65 179.14 4.77 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -131.37 156.47 80.09 Favored Pre-proline 0 C--N 1.323 -0.558 0 C-N-CA 124.162 0.985 . . . . 0.0 111.744 -169.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -63.95 -1.95 4.06 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 123.475 2.783 . . . . 0.0 115.292 -174.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -143.73 23.62 2.14 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 124.339 0.971 . . . . 0.0 112.849 171.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -151.1 98.15 2.53 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 170.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -66.11 -23.33 66.48 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.901 1.281 . . . . 0.0 114.299 -169.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -75.94 131.73 75.57 Favored Pre-proline 0 N--CA 1.436 -1.164 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 177.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.05 154.9 42.58 Favored 'Trans proline' 0 N--CA 1.448 -1.17 0 C-N-CA 122.218 1.945 . . . . 0.0 110.493 176.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 49.6 mm -117.35 124.72 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -88.86 -33.34 17.38 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 117.178 -1.391 . . . . 0.0 109.434 169.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 mt -116.19 131.11 57.04 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-N 120.034 1.288 . . . . 0.0 112.025 -169.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mp -136.84 104.99 5.66 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.9 mp -87.51 112.34 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 175.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.18 153.88 47.15 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 172.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.43 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -147.27 133.97 19.97 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 169.176 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.43 ' N ' HD23 ' A' ' 103' ' ' LEU . 93.0 p -127.62 147.69 50.36 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 126.344 1.858 . . . . 0.0 106.925 168.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -147.25 132.87 18.79 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -178.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.16 -22.74 60.44 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.721 0.408 . . . . 0.0 111.962 179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -144.42 155.82 43.93 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.678 0.791 . . . . 0.0 110.036 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.36 74.87 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.22 -31.22 62.53 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 120.839 -1.163 . . . . 0.0 111.032 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.7 m -64.65 -39.05 93.01 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.937 -0.477 . . . . 0.0 110.136 170.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -58.84 -48.84 79.92 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 123.637 0.775 . . . . 0.0 109.873 172.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 16.0 mm -55.92 -53.83 33.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.25 -39.28 94.39 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 118.837 0.744 . . . . 0.0 112.03 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.96 -53.3 27.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.459 1.104 . . . . 0.0 110.582 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -51.35 -47.44 34.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.47 1.508 . . . . 0.0 108.637 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -67.62 -10.66 54.13 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.499 1.12 . . . . 0.0 112.555 -177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -93.87 -46.17 7.31 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 123.973 0.909 . . . . 0.0 109.726 169.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.465 HD12 ' N ' ' A' ' 119' ' ' SER . 1.8 pp -72.66 -25.24 61.19 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 118.711 0.687 . . . . 0.0 112.108 -173.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.465 ' N ' HD12 ' A' ' 118' ' ' LEU . 4.9 p -61.18 -20.91 63.29 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.177 0.591 . . . . 0.0 112.152 172.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -65.7 -19.17 65.8 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.391 0.996 . . . . 0.0 110.098 172.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 36.5 mt -106.54 -63.29 1.29 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.639 1.576 . . . . 0.0 110.178 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.5 -23.85 59.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.533 1.933 . . . . 0.0 114.528 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.0 m -112.48 28.15 9.03 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 118.95 0.796 . . . . 0.0 110.165 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -132.89 102.57 5.69 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.863 0.865 . . . . 0.0 108.903 177.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -57.85 -26.92 62.72 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.938 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -62.09 -45.0 95.45 Favored 'General case' 0 C--N 1.34 0.152 0 C-N-CA 123.893 0.877 . . . . 0.0 110.123 174.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -69.06 -46.35 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 CA-C-O 117.961 -1.019 . . . . 0.0 108.728 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 8.8 mp -50.56 -44.18 56.57 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 119.541 1.064 . . . . 0.0 112.672 -176.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -71.25 -34.38 70.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 118.63 0.65 . . . . 0.0 110.384 -178.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -72.76 -34.43 67.0 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 121.404 -0.81 . . . . 0.0 109.68 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 55.7 mt -65.6 -53.47 41.27 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.9 mt -56.78 -32.43 65.64 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -174.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 37.2 p -88.24 -0.53 57.22 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.076 0.95 . . . . 0.0 112.26 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.87 138.64 57.22 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 119.127 0.876 . . . . 0.0 110.178 176.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.0 m -124.57 9.07 8.35 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.943 1.297 . . . . 0.0 110.754 176.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 74.8 p -152.16 153.66 34.31 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.491 1.116 . . . . 0.0 108.916 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -62.21 -32.12 72.74 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -58.07 -40.99 82.42 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.191 0.597 . . . . 0.0 111.842 176.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 14.3 tp60 -74.56 -30.89 61.91 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 119.429 1.013 . . . . 0.0 110.738 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.77 -50.15 52.82 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.407 1.003 . . . . 0.0 108.924 173.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.36 -31.1 65.41 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.515 1.126 . . . . 0.0 112.892 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -61.93 -45.85 91.88 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 120.842 -1.161 . . . . 0.0 110.038 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 95.7 mt -65.49 -37.2 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 123.987 0.915 . . . . 0.0 109.739 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ILE . . . . . 0.477 HD11 HD22 ' A' ' 81' ' ' LEU . 40.2 mm -56.24 -49.56 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-N 118.23 0.468 . . . . 0.0 110.128 169.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 39.2 m -66.84 -26.26 66.83 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -169.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -67.41 -34.86 78.11 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.776 0.717 . . . . 0.0 111.252 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.926 0 CA-C-O 117.815 -1.547 . . . . 0.0 110.375 -169.257 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tpp . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.705 0.288 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.34 106.45 1.71 Allowed 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 169.039 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.4 -42.9 96.88 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 175.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -56.03 -24.04 36.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.41 1.084 . . . . 0.0 112.773 -178.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.81 -22.68 66.8 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.097 0.862 . . . . 0.0 112.688 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -106.0 -10.2 16.69 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-O 116.52 -1.705 . . . . 0.0 113.593 -170.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -115.47 91.01 27.34 Favored Pre-proline 0 N--CA 1.477 0.925 0 CA-C-N 122.729 2.513 . . . . 0.0 108.433 -174.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -42.07 -75.07 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.804 1 C-N-CA 125.537 4.158 . . . . 0.0 116.795 -171.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.472 ' C ' ' H ' ' A' ' 11' ' ' SER . 8.0 tp10 -162.09 -76.69 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 124.032 0.933 . . . . 0.0 111.114 -173.098 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.1 m -66.86 6.35 0.51 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.544 1.537 . . . . 0.0 111.803 175.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.472 ' H ' ' C ' ' A' ' 9' ' ' GLU . 3.8 m -74.91 1.52 12.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 128.452 2.701 . . . . 0.0 113.247 -169.04 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.5 mt -130.69 131.82 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 -172.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.5 p -151.61 155.6 38.73 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 122.052 0.929 . . . . 0.0 111.347 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -127.59 136.1 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 103.297 -2.853 . . . . 0.0 103.297 169.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.1 mt -134.89 147.39 29.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 106.46 -1.682 . . . . 0.0 106.46 -169.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -63.24 -47.93 80.37 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.938 -0.476 . . . . 0.0 110.631 174.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 p -166.51 147.42 6.23 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -172.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.15 149.89 30.39 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 169.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -60.19 -41.03 92.07 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.02 0.528 . . . . 0.0 110.818 178.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -166.02 179.9 5.55 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 127.09 2.156 . . . . 0.0 107.658 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -64.61 -31.6 72.89 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.021 0.929 . . . . 0.0 112.567 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.433 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.2 mt-30 -62.95 -49.43 74.76 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 120.265 1.393 . . . . 0.0 107.872 169.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.47 -34.77 74.51 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 121.887 -0.508 . . . . 0.0 111.67 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.63 -35.52 79.85 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.936 -0.478 . . . . 0.0 110.124 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -71.27 -45.85 68.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 172.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -55.58 -44.71 77.17 Favored 'General case' 0 C--O 1.225 -0.203 0 O-C-N 121.747 -0.596 . . . . 0.0 110.8 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -65.76 -33.35 75.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.753 174.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.5 m -63.32 -19.91 65.03 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.638 1.108 . . . . 0.0 112.479 172.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.8 mmt -124.68 -20.97 4.92 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -168.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -59.66 -36.99 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 120.788 1.631 . . . . 0.0 111.916 -169.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.3 m -66.57 -19.79 65.86 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.941 0.791 . . . . 0.0 112.183 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.9 mt -86.03 -44.44 12.3 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 123.927 0.891 . . . . 0.0 109.072 170.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -56.38 -42.92 78.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.959 0.904 . . . . 0.0 110.772 -178.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -67.59 -23.03 65.34 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 125.758 1.623 . . . . 0.0 113.942 -170.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -115.38 26.44 10.07 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 122.558 0.343 . . . . 0.0 110.454 171.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 60.89 27.15 17.0 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 170.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -67.21 -22.15 65.73 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.133 -0.979 . . . . 0.0 110.814 169.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 pt -143.35 170.27 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 126.165 1.786 . . . . 0.0 108.879 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.6 m -102.63 158.79 15.99 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.304 1.841 . . . . 0.0 108.385 171.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.29 -32.43 70.03 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.227 -0.92 . . . . 0.0 112.372 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -58.23 -32.83 68.7 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.764 -0.585 . . . . 0.0 111.954 175.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -60.74 -42.65 97.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.586 0.754 . . . . 0.0 110.435 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -59.69 -50.8 78.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -69.11 -27.58 65.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.59 -0.719 . . . . 0.0 111.915 -173.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.17 -40.98 78.39 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.016 0.826 . . . . 0.0 110.757 174.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.5 mt -72.6 -49.23 42.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.433 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 90.8 mttt -58.36 -41.24 84.27 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 119.448 -0.31 . . . . 0.0 110.443 -175.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -59.39 -52.74 64.32 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.463 0.705 . . . . 0.0 111.051 -173.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.5 m -64.64 -40.69 95.91 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.789 0.436 . . . . 0.0 110.481 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.1 m -56.0 -39.23 71.58 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 119.098 -0.477 . . . . 0.0 111.671 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 90.3 mt -81.39 -47.03 20.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-N 118.808 0.731 . . . . 0.0 109.75 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -74.31 -31.97 62.69 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -169.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -126.63 -44.25 1.68 Allowed 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.005 0.922 . . . . 0.0 110.844 -169.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 138.0 163.53 9.65 Favored Glycine 0 CA--C 1.529 0.965 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -177.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -61.08 147.93 94.29 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.122 1.881 . . . . 0.0 109.599 176.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -135.05 12.72 3.6 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -169.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -134.01 75.64 1.61 Allowed 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 125.293 1.437 . . . . 0.0 107.483 169.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 50.2 mm -119.66 139.0 48.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 177.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mp -130.77 -25.18 2.35 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -169.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -158.5 161.86 27.74 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 173.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -48.64 118.38 3.34 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.775 2.317 . . . . 0.0 110.807 169.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.98 3.19 88.0 Favored Glycine 0 CA--C 1.533 1.199 0 CA-C-O 117.799 -1.556 . . . . 0.0 114.931 178.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 26.2 t -132.03 126.19 56.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-N 120.067 1.934 . . . . 0.0 108.882 -172.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.07 168.38 15.43 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.155 1.782 . . . . 0.0 109.768 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.45 ' CE ' HD11 ' A' ' 118' ' ' LEU . 5.4 ttm -137.31 60.41 26.97 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.035 0.934 . . . . 0.0 110.397 175.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -57.13 123.57 14.14 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 121.911 1.741 . . . . 0.0 110.362 -174.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.54 161.41 3.27 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.546 2.338 . . . . 0.0 106.855 -169.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -136.43 173.67 11.46 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.99 1.316 . . . . 0.0 109.343 -173.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 67.3 mtp85 -59.04 154.71 37.73 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 118.702 -0.666 . . . . 0.0 109.608 172.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.13 -39.59 84.08 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.204 1.936 . . . . 0.0 109.517 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -64.12 -12.92 44.12 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.558 1.543 . . . . 0.0 113.196 -177.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 73.6 m -77.17 -3.24 38.5 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.079 0.854 . . . . 0.0 111.784 177.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.85 19.6 1.98 Allowed Glycine 0 C--N 1.336 0.568 0 CA-C-O 118.245 -1.308 . . . . 0.0 112.689 173.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.75 145.32 56.13 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 119.502 1.651 . . . . 0.0 108.984 169.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -130.34 -30.57 1.92 Allowed 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 124.0 0.92 . . . . 0.0 111.047 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 mttt -148.04 155.6 41.68 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.939 1.296 . . . . 0.0 107.93 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 89.8 m -87.37 130.65 34.56 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 122.957 0.503 . . . . 0.0 111.592 -176.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -177.04 -177.98 46.4 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 125.173 1.368 . . . . 0.0 110.82 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.408 ' HG2' ' HA ' ' A' ' 103' ' ' LEU . 13.3 mtm -149.99 171.83 16.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 127.195 2.198 . . . . 0.0 109.731 -176.348 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.2 m -151.09 167.95 26.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.705 1.202 . . . . 0.0 109.273 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.7 tp -144.94 98.87 3.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 126.445 1.898 . . . . 0.0 108.468 -169.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 28.1 m -103.97 143.47 32.83 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.408 1.083 . . . . 0.0 108.69 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.4 tt -133.84 134.29 42.61 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 171.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -103.24 133.82 47.69 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.045 0.938 . . . . 0.0 108.653 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -67.62 -29.61 68.98 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 168.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -130.71 82.53 2.06 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 127.099 2.16 . . . . 0.0 106.796 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -46.98 157.61 0.53 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 113.083 -1.871 . . . . 0.0 113.743 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 95.5 t -123.8 150.68 28.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 -174.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -112.19 98.46 7.33 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.107 0.963 . . . . 0.0 110.663 -168.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -51.63 141.67 24.75 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 124.322 1.049 . . . . 0.0 110.827 169.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -73.1 68.27 4.06 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.165 3.244 . . . . 0.0 112.665 -176.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 167.8 -9.48 0.05 OUTLIER Glycine 0 CA--C 1.533 1.218 0 CA-C-O 118.719 -1.045 . . . . 0.0 114.467 173.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -71.74 -176.39 1.63 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.319 1.559 . . . . 0.0 110.384 172.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -93.81 -27.99 16.14 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.367 -0.833 . . . . 0.0 111.043 169.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -150.38 167.7 12.48 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.328 1.051 . . . . 0.0 112.805 -173.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -60.38 143.73 99.49 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 123.522 2.815 . . . . 0.0 112.49 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 25.5 mm -92.46 131.38 39.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 173.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -101.06 -19.31 15.86 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 116.351 -1.785 . . . . 0.0 110.923 169.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.7 mt -130.48 134.35 47.01 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 121.513 1.961 . . . . 0.0 111.887 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.7 mp -139.86 109.78 6.41 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -174.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.8 mp -92.34 119.23 39.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 175.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.36 153.03 34.9 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 170.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.547 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -151.38 143.55 24.01 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 170.567 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.547 ' N ' HD23 ' A' ' 103' ' ' LEU . 79.4 p -142.73 146.31 34.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 168.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.625 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -144.91 145.94 31.79 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 118.915 0.78 . . . . 0.0 109.716 170.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.69 -13.11 59.71 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.538 -0.465 . . . . 0.0 111.351 -176.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -137.04 151.26 48.72 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.63 0.772 . . . . 0.0 110.024 175.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.51 77.54 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -177.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -72.34 -30.03 64.37 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.119 -0.988 . . . . 0.0 110.946 176.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.442 ' HB2' ' HB1' ' A' ' 105' ' ' ALA . 20.0 m -66.94 -35.55 80.24 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.79 -0.569 . . . . 0.0 110.444 169.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.625 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 28.5 m-70 -62.19 -45.0 95.34 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.343 0.974 . . . . 0.0 109.85 170.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.1 mm -56.32 -52.03 56.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 118.946 0.794 . . . . 0.0 109.267 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.37 -39.69 95.08 Favored Glycine 0 CA--C 1.529 0.939 0 CA-C-N 118.945 0.793 . . . . 0.0 111.81 -177.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.86 67.46 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.411 0.684 . . . . 0.0 110.874 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.6 mm -58.04 -46.23 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 C-N-CA 124.607 1.163 . . . . 0.0 108.167 176.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -68.21 -12.04 60.29 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.139 -0.975 . . . . 0.0 111.527 -177.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.57 -48.58 6.54 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 124.276 1.031 . . . . 0.0 109.546 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.45 HD11 ' CE ' ' A' ' 65' ' ' MET . 4.2 pp -68.83 -28.3 66.61 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.643 -177.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.7 m -61.7 -20.21 63.22 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 118.822 -0.609 . . . . 0.0 112.393 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -67.19 -14.49 62.95 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.611 1.096 . . . . 0.0 110.734 171.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 32.6 mt -111.68 -59.51 1.97 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.683 1.593 . . . . 0.0 110.734 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.1 -37.25 74.16 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.669 1.188 . . . . 0.0 113.125 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 42.3 m -100.7 25.46 7.84 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.557 0.343 . . . . 0.0 110.679 -172.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -133.95 99.08 4.33 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 124.676 1.191 . . . . 0.0 108.121 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -57.04 -27.28 61.53 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.476 0.71 . . . . 0.0 112.309 -178.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -64.0 -43.14 96.56 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.277 0.631 . . . . 0.0 110.065 175.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.3 mp -70.6 -42.83 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.2 mt -53.6 -40.43 65.68 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 119.247 0.93 . . . . 0.0 112.262 -175.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -71.56 -33.99 69.59 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 118.847 0.748 . . . . 0.0 110.569 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -72.31 -33.74 67.6 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 121.418 -0.801 . . . . 0.0 109.733 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -66.19 -53.92 31.5 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 26.8 mt -55.78 -30.22 60.95 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.136 0.574 . . . . 0.0 112.54 -174.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 32.1 p -91.56 2.86 56.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.273 1.029 . . . . 0.0 112.131 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.81 104.26 0.81 Allowed 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.465 1.106 . . . . 0.0 110.564 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 11.7 m -69.05 -26.61 65.05 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.37 0.668 . . . . 0.0 111.78 175.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.9 m -148.17 159.28 44.11 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.271 1.428 . . . . 0.0 108.954 -172.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -54.43 -31.66 55.8 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.36 1.464 . . . . 0.0 112.021 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -56.05 -34.46 65.92 Favored 'General case' 0 C--O 1.227 -0.083 0 C-N-CA 123.298 0.639 . . . . 0.0 112.616 -177.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -80.98 -26.47 36.51 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 119.451 1.023 . . . . 0.0 110.547 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 82.1 mt -71.07 -48.86 50.18 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 173.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -54.85 -38.55 67.6 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.893 1.277 . . . . 0.0 112.711 171.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -59.16 -47.73 84.24 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 118.941 0.791 . . . . 0.0 110.196 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 67.2 mt -65.91 -37.01 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 123.537 0.735 . . . . 0.0 110.292 -178.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 20.9 mm -57.32 -53.55 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 169.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 83.8 p -64.01 -29.5 70.65 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.129 0.49 . . . . 0.0 111.989 -169.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -57.93 -26.39 62.16 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.331 1.852 . . . . 0.0 113.342 176.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.876 0 N-CA-C 108.538 -1.825 . . . . 0.0 108.538 -177.684 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.3 tpt . . . . . 0 N--CA 1.488 1.433 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -67.15 114.56 6.0 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 169.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.32 -38.58 68.88 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 125.037 1.335 . . . . 0.0 110.038 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.86 -20.94 9.83 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.442 1.497 . . . . 0.0 112.891 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.84 -31.92 71.25 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 119.088 0.858 . . . . 0.0 112.508 175.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -87.08 -27.14 23.32 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 118.486 -0.768 . . . . 0.0 112.765 -171.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -91.42 104.31 9.66 Favored Pre-proline 0 CA--C 1.542 0.651 0 N-CA-C 103.801 -2.666 . . . . 0.0 103.801 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -63.46 -68.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.099 1.866 . . . . 0.0 113.686 -168.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -164.09 161.16 22.27 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.358 1.863 . . . . 0.0 106.38 171.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.0 m 53.07 22.87 2.7 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.34 1.056 . . . . 0.0 112.949 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.4 m -114.56 24.05 12.19 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 125.406 1.482 . . . . 0.0 110.691 -169.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.8 mt -131.52 129.69 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 103.863 -2.643 . . . . 0.0 103.863 178.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 m -150.38 149.24 29.8 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.475 0.71 . . . . 0.0 111.109 -173.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.7 t -123.65 142.61 39.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 169.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.6 mt -142.27 148.91 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 126.316 1.846 . . . . 0.0 106.168 -169.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -73.6 -46.58 46.23 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.553 -0.717 . . . . 0.0 109.911 172.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 p -163.21 144.47 9.57 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.54 158.61 33.44 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 169.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -58.18 -42.01 85.13 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.894 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -167.26 -177.43 3.66 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 127.931 2.492 . . . . 0.0 107.546 172.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -63.26 -33.18 74.95 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.493 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.6 mt-30 -60.29 -49.75 76.38 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 120.558 1.526 . . . . 0.0 107.433 173.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -61.88 -34.06 75.34 Favored 'General case' 0 C--O 1.221 -0.396 0 O-C-N 121.588 -0.695 . . . . 0.0 111.378 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.23 -32.01 71.91 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.658 -0.651 . . . . 0.0 111.262 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -46.4 82.84 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 171.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -56.51 -44.88 81.16 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.724 -0.61 . . . . 0.0 110.096 176.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -68.63 -13.92 62.68 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.216 -0.928 . . . . 0.0 113.083 174.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.5 m -82.96 -17.54 43.15 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.664 1.574 . . . . 0.0 111.592 169.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 3.3 mmt -130.35 -16.65 3.48 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -168.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.6 p -56.28 -37.02 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 120.173 1.351 . . . . 0.0 113.07 -169.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.2 m -68.33 -29.8 68.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.049 0.84 . . . . 0.0 111.645 -178.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 mt -75.91 -41.14 52.76 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 172.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.3 tp -58.46 -45.72 88.01 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.389 0.676 . . . . 0.0 110.568 179.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -60.15 -35.5 75.45 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.523 1.129 . . . . 0.0 112.118 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -96.54 17.25 16.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.738 -177.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.287 3.5 p30 43.06 38.17 1.39 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.941 1.696 . . . . 0.0 113.502 -176.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.438 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 24.3 m-85 -73.21 -18.05 61.29 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 168.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.9 pt -145.98 166.95 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 127.113 2.165 . . . . 0.0 108.522 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 p -94.84 165.03 12.67 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.52 1.128 . . . . 0.0 109.24 169.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.99 -35.64 75.45 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.279 -0.888 . . . . 0.0 111.066 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.06 -21.33 66.37 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.205 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -62.0 -42.72 99.46 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.526 1.057 . . . . 0.0 110.0 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -58.86 -50.3 79.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 123.45 0.7 . . . . 0.0 109.207 175.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -70.36 -24.76 63.02 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.924 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.42 -42.86 92.83 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.406 1.003 . . . . 0.0 110.252 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 74.5 mt -66.95 -47.15 83.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.493 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 93.2 mttt -60.72 -37.78 82.88 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.012 -177.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.53 -46.94 88.32 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 119.003 0.82 . . . . 0.0 111.301 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 46.2 m -68.48 -29.85 68.56 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.578 -0.701 . . . . 0.0 111.405 174.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 37.8 m -62.76 -39.78 95.22 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.279 0.491 . . . . 0.0 110.172 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 89.9 mt -67.28 -48.63 77.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 119.008 0.822 . . . . 0.0 109.319 173.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -68.56 -33.78 74.68 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -169.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -147.19 -44.96 0.17 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.468 0.707 . . . . 0.0 111.859 -168.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 140.83 177.52 16.27 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 119.107 -0.83 . . . . 0.0 111.333 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -37.11 127.54 0.55 Allowed 'Trans proline' 0 N--CA 1.458 -0.596 1 C-N-CA 125.586 4.191 . . . . 0.0 114.674 176.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -51.72 -40.62 60.51 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.233 1.013 . . . . 0.0 113.248 174.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -144.4 134.67 24.34 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-N 118.987 0.812 . . . . 0.0 109.892 -177.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.1 mm -140.4 138.48 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 177.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -123.27 -32.24 3.45 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.294 0.638 . . . . 0.0 111.692 -169.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.03 158.97 24.73 Favored Pre-proline 0 C--O 1.237 0.433 0 C-N-CA 126.927 2.091 . . . . 0.0 105.627 -175.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -60.0 117.04 3.74 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 121.505 1.47 . . . . 0.0 109.541 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 94.48 6.33 61.19 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.349 -1.25 . . . . 0.0 113.641 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.0 t -130.62 122.5 52.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 119.477 1.639 . . . . 0.0 108.197 -171.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.9 167.52 14.55 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.575 1.55 . . . . 0.0 109.461 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.425 ' CE ' HD13 ' A' ' 118' ' ' LEU . 12.8 ttm -143.38 66.81 16.23 Favored Pre-proline 0 C--N 1.331 -0.219 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 175.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -58.69 147.51 87.28 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 CA-C-O 122.472 0.947 . . . . 0.0 111.511 -173.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -179.54 155.02 0.65 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 128.365 2.666 . . . . 0.0 105.444 -169.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -133.9 153.74 51.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 169.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -54.45 145.14 39.49 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-O 117.685 -1.15 . . . . 0.0 109.377 -177.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -44.46 -44.91 13.21 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 123.818 3.012 . . . . 0.0 113.204 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.0 -14.51 48.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.617 1.567 . . . . 0.0 113.151 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 65.3 m -73.64 -25.24 60.19 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 118.613 0.642 . . . . 0.0 110.771 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 150.97 17.35 0.07 OUTLIER Glycine 0 C--N 1.337 0.609 0 CA-C-O 118.295 -1.28 . . . . 0.0 114.154 -178.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.22 152.54 44.94 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.142 1.471 . . . . 0.0 109.372 169.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.2 mt -131.65 -31.86 1.53 Allowed 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 124.128 0.971 . . . . 0.0 110.724 -175.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.438 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 75.3 mttt -146.68 158.24 43.87 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 125.628 1.571 . . . . 0.0 108.496 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.3 m -92.15 122.84 35.03 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.086 0.554 . . . . 0.0 110.184 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.07 -176.15 38.92 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.697 1.141 . . . . 0.0 111.02 -177.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 51.7 mtt -145.85 172.31 13.52 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.397 1.479 . . . . 0.0 110.64 -176.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 70.2 m -149.5 160.41 43.49 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.802 1.241 . . . . 0.0 109.06 169.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.4 tp -136.47 121.27 18.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.177 1.791 . . . . 0.0 108.892 -172.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.478 ' O ' HD22 ' A' ' 99' ' ' LEU . 91.5 m -137.63 129.76 29.09 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -171.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.2 tp -122.89 139.1 54.4 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.8 mp -119.84 118.81 31.77 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 126.559 1.944 . . . . 0.0 106.433 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -60.12 -24.5 64.73 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.769 0.827 . . . . 0.0 113.007 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -115.58 -9.28 12.04 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.63 1.172 . . . . 0.0 111.946 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 61.17 -176.98 4.51 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 123.734 0.683 . . . . 0.0 112.119 -169.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -149.6 160.62 5.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 169.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -105.32 108.33 19.78 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.519 0.676 . . . . 0.0 110.96 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -74.9 135.28 74.24 Favored Pre-proline 0 N--CA 1.448 -0.532 0 C-N-CA 124.572 1.149 . . . . 0.0 108.396 170.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -66.28 156.87 62.92 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.492 2.128 . . . . 0.0 110.474 176.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 70.65 24.4 76.93 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-O 119.602 -0.554 . . . . 0.0 113.451 173.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 42.5 t30 -136.86 164.72 27.64 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.292 1.437 . . . . 0.0 107.747 171.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -78.94 -25.44 43.62 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -172.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -147.33 164.74 21.5 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.214 0.606 . . . . 0.0 112.512 -169.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.2 144.62 26.65 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.12 2.547 . . . . 0.0 111.031 177.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 22.1 mm -87.13 131.9 33.87 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt -103.88 -25.76 12.93 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.97 169.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.478 HD22 ' O ' ' A' ' 82' ' ' THR . 3.0 tm? -134.06 132.27 39.81 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 120.655 1.57 . . . . 0.0 109.966 -174.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -131.24 126.76 36.33 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -174.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.0 mt -109.84 103.59 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 169.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -66.6 146.8 49.05 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 169.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.457 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -143.0 138.07 29.76 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 104.907 -2.257 . . . . 0.0 104.907 169.568 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.457 ' N ' HD23 ' A' ' 103' ' ' LEU . 94.9 p -131.34 147.95 52.62 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 126.139 1.775 . . . . 0.0 106.762 168.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -147.33 135.35 21.37 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.26 -21.52 58.5 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.753 0.421 . . . . 0.0 111.81 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -144.66 155.8 43.78 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.02 0.928 . . . . 0.0 109.825 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.18 -35.42 75.34 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.0 -31.05 62.78 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 120.894 -1.128 . . . . 0.0 111.064 176.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.8 m -64.8 -38.34 90.64 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.926 -0.484 . . . . 0.0 110.33 170.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -59.31 -49.72 76.76 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 123.521 0.729 . . . . 0.0 109.662 171.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.2 mm -55.37 -52.61 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.03 -39.72 96.07 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-N 119.098 0.863 . . . . 0.0 112.093 -177.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.85 -52.82 32.36 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.291 1.036 . . . . 0.0 110.635 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.9 mm -51.8 -47.86 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 C-N-CA 125.414 1.485 . . . . 0.0 108.571 174.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -67.45 -9.96 46.94 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 120.931 -1.106 . . . . 0.0 112.31 -177.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -91.46 -49.95 6.05 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 169.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.534 HD12 ' N ' ' A' ' 119' ' ' SER . 1.0 OUTLIER -70.77 -22.84 62.34 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -173.456 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.534 ' N ' HD12 ' A' ' 118' ' ' LEU . 33.7 m -62.95 -25.68 68.47 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.673 0.789 . . . . 0.0 111.135 172.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -66.75 -22.89 66.04 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.582 -0.699 . . . . 0.0 109.427 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 32.1 mt -95.04 -71.92 0.65 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.208 1.003 . . . . 0.0 110.621 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 22.5 mt -68.57 -16.47 63.87 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -169.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 32.1 m -97.28 27.75 4.02 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 120.176 1.353 . . . . 0.0 111.423 177.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -132.4 112.86 12.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.209 1.804 . . . . 0.0 106.388 173.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -61.89 -26.21 68.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.981 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -64.15 -42.87 96.59 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.006 0.523 . . . . 0.0 109.99 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.93 -43.21 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 123.689 0.796 . . . . 0.0 109.146 175.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 46.4 mt -55.02 -42.27 72.39 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 118.934 0.788 . . . . 0.0 111.095 -176.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -69.12 -36.5 77.56 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 118.579 -0.724 . . . . 0.0 111.015 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -65.21 -40.25 93.89 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 119.627 1.103 . . . . 0.0 108.951 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 24.6 mt -66.95 -52.6 40.97 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 176.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 54.9 mt -63.61 -9.0 11.42 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 61.1 p -122.7 10.48 9.66 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.688 1.195 . . . . 0.0 111.356 176.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.93 113.22 2.67 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 124.289 1.036 . . . . 0.0 109.72 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.5 m -74.63 -15.38 60.82 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.864 0.866 . . . . 0.0 112.212 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 85.8 p -153.05 163.09 40.48 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.894 0.854 . . . . 0.0 111.599 -173.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -58.04 -37.61 74.72 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.883 1.273 . . . . 0.0 109.494 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -60.67 -41.41 95.02 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 123.102 0.561 . . . . 0.0 110.945 175.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -65.38 -36.32 83.64 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 118.752 0.706 . . . . 0.0 112.138 176.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 36.4 mt -65.28 -46.93 78.47 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.641 1.11 . . . . 0.0 108.69 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.66 -32.97 67.83 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.921 0.888 . . . . 0.0 113.203 172.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -67.58 -40.52 84.84 Favored 'General case' 0 C--N 1.33 -0.243 0 O-C-N 121.103 -0.998 . . . . 0.0 110.412 177.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 71.1 mt -66.52 -36.76 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 123.777 0.831 . . . . 0.0 109.427 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.0 mm -58.61 -52.11 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 169.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 22.7 m -63.88 -27.78 69.39 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.259 0.224 . . . . 0.0 111.415 -173.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -60.09 -26.31 66.09 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.399 1.48 . . . . 0.0 113.104 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.867 0 N-CA-C 108.662 -1.775 . . . . 0.0 108.662 -178.643 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 tpp . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.4 mmm-85 -65.53 117.23 7.71 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 169.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.27 -44.92 94.91 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 177.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.3 p -56.36 -19.75 16.09 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.295 1.038 . . . . 0.0 113.187 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.25 -26.6 68.86 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.738 1.153 . . . . 0.0 112.338 174.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -96.87 -23.41 16.37 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 118.241 -0.885 . . . . 0.0 112.852 -172.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -101.81 101.55 18.76 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 120.298 1.408 . . . . 0.0 107.331 -173.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.55 -64.44 0.08 OUTLIER 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.378 2.719 . . . . 0.0 115.164 -169.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.439 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.9 tp10 -158.94 -77.68 0.07 Allowed 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.74 0.816 . . . . 0.0 111.908 -172.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.23 10.86 0.27 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.089 1.355 . . . . 0.0 111.502 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.439 ' H ' ' C ' ' A' ' 9' ' ' GLU . 1.8 p -79.27 12.09 2.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.149 2.18 . . . . 0.0 113.329 -169.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 mp -135.24 130.11 50.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 173.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.6 m -144.35 153.76 42.31 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.034 0.534 . . . . 0.0 110.866 175.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 74.1 t -122.81 142.23 40.14 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 106.182 -1.784 . . . . 0.0 106.182 170.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.4 mt -140.59 146.11 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 -170.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 48.8 m-70 -65.42 -51.94 56.8 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 174.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -159.0 147.63 18.3 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.497 ' HB3' HG21 ' A' ' 88' ' ' VAL . . . -76.06 149.84 37.42 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 171.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 tmmm? -58.2 -39.22 78.39 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.029 0.532 . . . . 0.0 109.788 177.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -161.67 175.93 11.5 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 126.465 1.906 . . . . 0.0 107.937 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -69.16 -33.69 73.8 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 123.364 0.665 . . . . 0.0 111.552 174.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.405 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 4.8 pt20 -61.18 -41.82 97.48 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 119.858 1.208 . . . . 0.0 108.884 169.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -67.44 -32.89 74.06 Favored 'General case' 0 C--O 1.223 -0.319 0 O-C-N 121.606 -0.684 . . . . 0.0 111.561 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -34.83 78.94 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.946 0.498 . . . . 0.0 110.005 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.34 -46.79 80.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 169.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -55.12 -47.23 75.33 Favored 'General case' 0 C--O 1.226 -0.171 0 C-N-CA 122.954 0.501 . . . . 0.0 110.047 -176.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -66.28 -31.37 72.13 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.441 174.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.8 m -61.87 -22.49 65.58 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.918 1.235 . . . . 0.0 112.032 172.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.2 mmt -123.06 -17.51 6.67 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -169.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.34 -36.51 52.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 120.619 1.554 . . . . 0.0 113.019 -169.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.6 m -67.31 -31.76 72.27 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.989 0.813 . . . . 0.0 110.932 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 73.3 mt -73.49 -40.95 63.7 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.748 0.819 . . . . 0.0 109.106 173.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.0 tp -59.34 -44.61 92.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.455 0.702 . . . . 0.0 110.495 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -64.25 -42.51 96.48 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 124.222 1.009 . . . . 0.0 111.693 -176.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.3 13.7 3.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.98 1.312 . . . . 0.0 111.735 175.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.301 6.2 p30 44.51 37.47 2.13 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.68 1.992 . . . . 0.0 114.944 -176.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -69.9 -18.94 63.42 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.088 -1.008 . . . . 0.0 109.492 168.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.7 pt -145.86 168.33 7.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 126.736 2.014 . . . . 0.0 108.766 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 m -106.13 162.02 14.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.775 1.63 . . . . 0.0 108.695 169.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -58.78 -36.88 75.15 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.172 -0.955 . . . . 0.0 112.28 -174.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -59.99 -24.08 64.16 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.893 0.877 . . . . 0.0 113.007 175.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -63.74 -46.16 86.59 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 119.485 1.039 . . . . 0.0 110.264 175.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.5 -47.92 90.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -66.94 -27.66 67.65 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 118.473 -0.775 . . . . 0.0 111.774 -175.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.35 74.33 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.323 0.965 . . . . 0.0 111.691 173.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 26.1 mt -76.12 -50.59 22.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 82.3 mttt -57.89 -44.68 86.86 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 -173.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.9 -50.69 71.2 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.377 0.671 . . . . 0.0 111.071 -172.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.5 m -66.2 -38.74 88.72 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 118.051 0.387 . . . . 0.0 110.744 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.1 m -56.25 -46.45 79.62 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.137 0.575 . . . . 0.0 111.012 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 73.5 mt -71.07 -42.22 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 123.243 0.617 . . . . 0.0 109.979 -178.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -77.88 -33.66 51.91 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -169.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -23.25 1.65 Allowed 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -169.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.64 161.17 10.91 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 125.109 1.338 . . . . 0.0 110.18 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -64.04 153.33 76.65 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.219 1.946 . . . . 0.0 110.126 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -131.73 14.46 4.87 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -171.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -139.01 80.96 1.82 Allowed 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 125.073 1.349 . . . . 0.0 107.989 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.5 mm -124.29 136.64 59.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -122.25 -30.38 4.01 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.304 0.642 . . . . 0.0 111.666 -169.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.59 160.91 27.73 Favored Pre-proline 0 C--O 1.236 0.351 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -57.08 113.51 1.51 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 121.857 1.704 . . . . 0.0 108.959 169.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.22 -8.94 49.52 Favored Glycine 0 CA--C 1.531 1.088 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.187 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.2 t -129.48 125.1 61.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 CA-C-N 119.943 1.871 . . . . 0.0 109.831 -169.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -123.68 167.99 13.25 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 125.687 1.595 . . . . 0.0 109.684 175.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 ttm -141.86 62.27 14.22 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -49.58 142.3 24.41 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.417 2.078 . . . . 0.0 114.421 -175.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 179.93 153.7 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 128.754 2.822 . . . . 0.0 106.256 -171.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.92 159.26 42.01 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 125.741 1.616 . . . . 0.0 107.609 169.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 32.1 mtp-105 -51.16 142.66 18.37 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-O 117.707 -1.139 . . . . 0.0 109.203 177.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_exo -45.53 -42.02 18.38 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.716 2.944 . . . . 0.0 113.091 -178.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -61.31 -14.48 27.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.429 1.492 . . . . 0.0 113.336 -177.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.9 m -77.76 -9.27 58.92 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.588 0.755 . . . . 0.0 112.011 -178.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 137.12 17.28 0.71 Allowed Glycine 0 CA--C 1.527 0.82 0 CA-C-O 118.195 -1.336 . . . . 0.0 113.868 178.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.97 149.38 47.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.801 1.8 . . . . 0.0 109.463 169.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.2 mt -129.43 -35.86 1.72 Allowed 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.781 1.233 . . . . 0.0 110.146 -176.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -144.76 158.93 43.6 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.502 1.521 . . . . 0.0 108.49 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 76.1 m -90.97 127.25 36.34 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.147 0.579 . . . . 0.0 110.367 -178.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -170.98 -178.69 41.7 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.978 1.275 . . . . 0.0 110.836 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 37.9 mtt -145.44 170.36 16.53 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.675 1.59 . . . . 0.0 110.713 -177.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.8 m -152.79 171.5 18.16 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.355 1.462 . . . . 0.0 109.245 169.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.9 tp -143.81 128.86 18.6 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 127.052 2.141 . . . . 0.0 107.895 -169.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 90.5 m -130.46 143.14 50.57 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.057 1.343 . . . . 0.0 107.554 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.2 tp -134.17 143.33 47.83 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 171.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -113.3 137.73 51.06 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.591 1.156 . . . . 0.0 108.724 176.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -69.36 -40.98 77.15 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 168.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -118.92 96.35 5.21 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.964 2.106 . . . . 0.0 107.996 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -50.85 156.96 2.51 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.002 1.286 . . . . 0.0 112.942 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.497 HG21 ' HB3' ' A' ' 18' ' ' ALA . 84.1 t -118.84 152.78 21.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -113.85 93.95 4.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.899 0.879 . . . . 0.0 110.458 -167.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -47.25 135.45 9.16 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.078 169.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -61.5 133.47 45.98 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 121.805 1.67 . . . . 0.0 110.393 -175.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 71.44 7.95 65.37 Favored Glycine 0 CA--C 1.533 1.203 0 CA-C-O 118.458 -1.19 . . . . 0.0 114.444 176.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -71.98 173.45 8.37 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.85 1.825 . . . . 0.0 111.131 174.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -65.55 -45.94 81.44 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 122.098 -0.376 . . . . 0.0 111.176 173.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -159.99 173.71 4.63 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 125.588 1.555 . . . . 0.0 112.344 -176.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -57.21 154.68 33.03 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.185 2.59 . . . . 0.0 113.391 173.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 39.9 mm -111.42 132.83 58.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -105.44 -15.4 15.03 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 117.347 -1.311 . . . . 0.0 110.973 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 46.4 tp -140.21 131.08 25.99 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 120.279 1.4 . . . . 0.0 109.979 -169.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.8 mp -137.53 138.87 40.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -176.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 3.7 mt -118.03 119.88 62.81 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 169.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.21 148.47 32.88 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.964 -1.654 . . . . 0.0 108.964 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.413 HD12 HD21 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -143.13 136.79 28.59 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 104.402 -2.444 . . . . 0.0 104.402 169.445 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.0 p -129.95 147.48 51.71 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 106.43 -1.692 . . . . 0.0 106.43 169.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.3 136.35 23.56 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 118.911 0.778 . . . . 0.0 109.244 -176.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.19 -22.63 55.1 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.804 0.442 . . . . 0.0 111.87 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -145.66 155.86 43.28 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.826 0.85 . . . . 0.0 109.984 -178.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.18 -34.97 74.33 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -75.09 -31.92 61.33 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 120.84 -1.162 . . . . 0.0 111.01 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.5 m -63.55 -40.59 97.39 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 122.095 -0.378 . . . . 0.0 110.025 169.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -58.28 -48.75 79.49 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.753 0.821 . . . . 0.0 110.104 172.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 11.1 mm -56.21 -53.63 37.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 123.472 0.709 . . . . 0.0 109.345 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.9 -39.05 96.39 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 118.822 0.737 . . . . 0.0 111.691 -176.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.61 -52.51 44.45 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.343 1.057 . . . . 0.0 110.451 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.5 mm -53.05 -47.32 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 C-N-CA 125.322 1.449 . . . . 0.0 108.791 176.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -66.96 -16.29 64.25 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.735 -0.603 . . . . 0.0 111.858 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -87.48 -46.38 9.65 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.695 0.798 . . . . 0.0 109.534 174.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.413 HD21 HD12 ' A' ' 103' ' ' LEU . 3.9 pp -71.17 -23.95 62.15 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.171 -178.122 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 63.0 m -59.5 -23.4 62.75 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.4 0.68 . . . . 0.0 112.11 172.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -64.62 -20.92 66.56 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.164 0.893 . . . . 0.0 110.25 173.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 31.0 mt -106.59 -60.71 1.63 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.631 1.572 . . . . 0.0 111.095 -178.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.24 -31.55 69.18 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.916 1.286 . . . . 0.0 113.622 -177.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 60.5 m -101.67 26.97 6.78 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 118.681 0.673 . . . . 0.0 110.832 -175.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -139.94 93.21 2.62 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -170.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.1 -27.0 41.83 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.949 0.9 . . . . 0.0 112.756 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.95 -45.55 91.95 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 122.882 0.473 . . . . 0.0 110.034 176.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.5 mp -68.16 -45.34 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.907 0.883 . . . . 0.0 108.817 175.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 73.0 mt -54.78 -42.69 72.06 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 118.753 -0.642 . . . . 0.0 111.291 -174.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -67.05 -40.87 87.19 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 118.407 0.549 . . . . 0.0 110.601 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.19 -33.99 74.23 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 118.71 0.687 . . . . 0.0 110.124 -176.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 23.4 mt -69.74 -53.37 18.72 Favored 'General case' 0 C--O 1.224 -0.239 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 170.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 31.4 mt -57.41 -21.05 33.92 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -176.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 82.6 p -114.21 8.53 16.88 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.539 1.136 . . . . 0.0 111.181 -177.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.92 125.32 22.56 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.206 1.002 . . . . 0.0 110.244 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.9 m -85.27 -10.1 56.9 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.119 0.968 . . . . 0.0 111.683 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 71.9 p -154.4 159.19 40.97 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.903 0.774 . . . . 0.0 110.451 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -59.16 -33.51 71.01 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.175 0.59 . . . . 0.0 109.644 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -57.75 -39.27 76.96 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 118.967 -0.539 . . . . 0.0 111.236 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -66.32 -44.4 83.48 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.806 0.73 . . . . 0.0 111.671 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.02 -50.28 71.3 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.769 0.713 . . . . 0.0 109.135 178.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.01 -32.6 66.31 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.912 1.285 . . . . 0.0 113.381 173.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.12 -43.26 82.87 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 119.877 1.217 . . . . 0.0 110.054 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 88.9 mt -64.91 -36.43 77.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 123.732 0.813 . . . . 0.0 109.587 178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 29.8 mm -58.51 -52.28 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 33.8 m -66.77 -26.41 66.95 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.754 0.422 . . . . 0.0 111.385 -171.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -57.69 -28.85 64.18 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.868 1.667 . . . . 0.0 113.001 173.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.933 0 N-CA-C 109.002 -1.639 . . . . 0.0 109.002 -174.765 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 tpt . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -66.79 109.21 2.8 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 169.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -52.24 -42.08 63.32 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.211 0.604 . . . . 0.0 110.05 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.61 -22.47 13.55 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.853 1.661 . . . . 0.0 113.485 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -65.71 -26.85 67.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.153 0.888 . . . . 0.0 112.094 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -96.71 -19.08 19.23 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.189 -170.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -97.7 112.72 62.22 Favored Pre-proline 0 CA--C 1.546 0.809 0 CA-C-N 120.864 1.665 . . . . 0.0 108.75 -173.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.69 -173.22 0.09 OUTLIER 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 125.236 3.957 . . . . 0.0 114.711 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -72.99 145.61 46.58 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 171.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.1 m 50.08 24.36 1.38 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.359 1.464 . . . . 0.0 112.428 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 p -74.49 -9.04 58.2 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.444 -0.785 . . . . 0.0 112.357 -172.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.4 mp -115.49 136.94 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 C-N-CA 126.634 1.973 . . . . 0.0 107.048 -170.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.7 m -144.76 156.22 43.94 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.714 1.206 . . . . 0.0 110.335 -177.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.6 t -129.66 144.55 37.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 174.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mt -143.29 150.09 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 126.294 1.838 . . . . 0.0 106.539 -170.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -74.93 -48.2 25.8 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.565 -0.709 . . . . 0.0 109.883 171.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -159.95 144.19 14.6 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.184 -1.413 . . . . 0.0 107.184 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.17 162.12 24.87 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 169.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.3 tppt? -59.37 -43.75 92.83 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.033 0.533 . . . . 0.0 110.554 178.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -167.17 -178.1 3.98 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 127.679 2.392 . . . . 0.0 107.758 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.5 p-90 -64.3 -32.7 74.41 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.498 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.4 mt-30 -59.31 -52.7 64.52 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.706 1.594 . . . . 0.0 107.381 172.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -60.05 -36.55 77.56 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 121.803 -0.56 . . . . 0.0 111.295 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.61 -30.14 71.16 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 118.833 -0.603 . . . . 0.0 111.09 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -69.09 -47.7 73.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 119.292 0.951 . . . . 0.0 108.548 172.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -55.68 -47.74 76.26 Favored 'General case' 0 C--O 1.227 -0.098 0 CA-C-N 118.315 0.507 . . . . 0.0 109.883 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -61.41 -33.59 73.96 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 117.928 -1.034 . . . . 0.0 111.974 174.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.1 m -64.83 -29.97 70.95 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 119.987 1.267 . . . . 0.0 112.428 175.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.6 mmm -115.95 -13.98 11.27 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -168.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -58.58 -33.85 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 120.299 1.409 . . . . 0.0 112.514 -169.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.7 p -65.78 -37.62 86.8 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.327 0.967 . . . . 0.0 110.652 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 77.7 mt -72.17 -37.81 69.26 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.587 0.755 . . . . 0.0 109.268 175.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.47 -44.23 96.1 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.685 0.675 . . . . 0.0 110.306 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -63.89 -45.09 90.91 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.878 1.271 . . . . 0.0 111.827 -176.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -80.44 12.52 2.96 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.282 1.033 . . . . 0.0 111.595 175.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.33 4.6 p30 43.54 43.21 4.46 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.821 2.049 . . . . 0.0 114.891 -176.263 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.412 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 35.9 m-85 -75.96 -17.15 59.84 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 167.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.5 pt -145.26 173.82 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.653 1.981 . . . . 0.0 109.271 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.6 m -114.66 163.03 16.0 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.164 1.786 . . . . 0.0 109.267 169.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.21 -32.82 72.59 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.308 -0.87 . . . . 0.0 113.047 -170.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -58.23 -30.89 66.87 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.83 -0.544 . . . . 0.0 111.729 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -59.06 -46.59 87.86 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.391 0.676 . . . . 0.0 110.38 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.8 mp -56.73 -48.37 81.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 123.612 0.765 . . . . 0.0 109.001 176.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -69.29 -26.24 64.64 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.264 -0.874 . . . . 0.0 112.027 -176.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.2 -39.37 93.84 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.828 1.195 . . . . 0.0 111.508 173.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 53.3 mt -66.5 -46.42 86.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.498 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.5 mttt -62.09 -42.4 99.18 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -178.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.18 -38.61 91.68 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 124.009 0.924 . . . . 0.0 111.407 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 m -62.93 -40.54 97.92 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.815 -0.553 . . . . 0.0 110.187 172.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 26.1 m -61.44 -38.52 87.47 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.762 0.825 . . . . 0.0 111.17 174.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.5 mt -64.42 -44.9 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 119.92 1.236 . . . . 0.0 109.817 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -65.23 -37.71 88.11 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -169.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -142.53 -9.56 0.83 Allowed 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 -168.293 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.48 178.42 32.61 Favored Glycine 0 CA--C 1.532 1.114 0 N-CA-C 107.711 -2.156 . . . . 0.0 107.711 -168.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -59.72 140.35 93.02 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 121.782 1.655 . . . . 0.0 109.384 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -126.48 10.46 7.29 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -134.78 88.1 2.4 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 169.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.4 mm -135.67 131.96 50.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 -173.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -124.55 -24.41 4.21 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 123.805 0.691 . . . . 0.0 110.918 -172.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.53 165.28 19.07 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 124.689 1.196 . . . . 0.0 108.112 170.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -49.35 126.94 16.79 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.338 2.025 . . . . 0.0 110.062 169.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.39 1.82 77.19 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-O 117.88 -1.511 . . . . 0.0 115.48 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 77.8 t -131.01 117.31 37.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-N 120.322 2.061 . . . . 0.0 108.355 -173.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.17 163.57 16.87 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.687 1.595 . . . . 0.0 109.917 -177.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.7 ttm -134.14 60.68 46.1 Favored Pre-proline 0 CA--C 1.545 0.751 0 CA-C-O 118.998 -0.525 . . . . 0.0 112.096 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -54.06 147.82 42.03 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.345 2.03 . . . . 0.0 113.293 -172.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 175.6 157.52 0.21 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 128.726 2.811 . . . . 0.0 106.542 -168.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.39 159.12 42.85 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 126.137 1.775 . . . . 0.0 107.931 169.399 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -51.21 143.34 17.52 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-O 118.3 -0.857 . . . . 0.0 109.322 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -47.91 -42.07 31.81 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.079 2.519 . . . . 0.0 113.017 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -62.22 -13.34 26.9 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.873 1.269 . . . . 0.0 114.05 -177.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 72.2 m -77.39 -6.12 52.21 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.636 0.774 . . . . 0.0 111.897 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 132.91 18.03 1.12 Allowed Glycine 0 CA--C 1.524 0.655 0 CA-C-O 118.206 -1.33 . . . . 0.0 113.315 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.45 148.13 49.99 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.792 1.796 . . . . 0.0 108.986 169.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.6 mt -127.66 -35.19 2.14 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 124.827 1.251 . . . . 0.0 110.501 -175.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.412 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 52.8 mttp -142.4 158.83 43.28 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 125.707 1.603 . . . . 0.0 107.916 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.1 m -91.15 125.17 35.85 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 123.157 0.583 . . . . 0.0 109.709 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -171.94 179.79 43.38 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.672 1.13 . . . . 0.0 110.966 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.627 ' SD ' HD21 ' A' ' 118' ' ' LEU . 56.7 mtt -143.23 167.95 20.92 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 125.453 1.501 . . . . 0.0 110.154 -172.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.4 p -148.57 167.53 25.16 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.926 1.291 . . . . 0.0 108.346 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.486 HD22 HD11 ' A' ' 144' ' ' ILE . 5.1 tp -142.75 124.71 15.22 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.609 -0.682 . . . . 0.0 109.77 -176.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 64.9 m -131.77 133.49 44.81 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.5 tp -126.44 139.11 53.5 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 173.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.3 mp -119.31 123.27 43.81 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 105.296 -2.112 . . . . 0.0 105.296 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.1 -41.26 92.18 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.666 0.667 . . . . 0.0 111.532 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 -90.69 -16.7 28.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.383 1.073 . . . . 0.0 111.724 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.21 178.86 9.1 Favored Glycine 0 CA--C 1.534 1.272 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -168.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.07 156.88 15.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 168.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -102.87 99.29 9.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.908 0.861 . . . . 0.0 112.189 -168.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -67.29 142.24 96.6 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 114.332 -1.304 . . . . 0.0 108.484 169.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -75.49 69.02 6.03 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 124.082 3.188 . . . . 0.0 113.241 -169.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 165.3 -11.3 0.07 OUTLIER Glycine 0 CA--C 1.531 1.088 0 CA-C-O 118.336 -1.258 . . . . 0.0 116.015 169.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -70.36 169.57 13.63 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.776 1.788 . . . . 0.0 110.48 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -69.12 -32.42 71.8 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.45 -0.782 . . . . 0.0 111.705 170.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.87 168.73 10.42 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 124.546 1.138 . . . . 0.0 112.153 -175.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -51.26 131.25 35.25 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.368 2.712 . . . . 0.0 112.116 174.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 27.9 mm -69.47 111.41 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 175.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -82.94 -29.53 29.05 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 116.743 -1.599 . . . . 0.0 110.409 169.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.8 tp -132.68 139.94 47.9 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 121.174 1.806 . . . . 0.0 112.126 -173.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.0 mp -134.6 103.27 5.6 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -178.179 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.654 HG21 HD22 ' A' ' 118' ' ' LEU . 0.6 OUTLIER -83.17 118.1 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.142 0 N-CA-C 104.442 -2.429 . . . . 0.0 104.442 169.258 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.35 150.81 26.23 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 172.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.405 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -142.9 142.86 31.83 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 169.839 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.405 ' N ' HD23 ' A' ' 103' ' ' LEU . 16.3 m -142.85 143.52 32.13 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 169.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.46 139.08 29.7 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 -169.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.39 -23.26 43.39 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.153 0.581 . . . . 0.0 111.92 -176.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -145.48 156.63 43.85 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.172 0.989 . . . . 0.0 109.809 -178.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.77 -34.75 73.4 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.178 0.806 . . . . 0.0 113.178 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -75.78 -32.34 59.86 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 120.936 -1.103 . . . . 0.0 111.062 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.2 m -62.32 -42.01 99.01 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 169.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 35.5 t60 -57.92 -49.09 77.94 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.034 0.933 . . . . 0.0 110.211 173.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 8.9 mm -56.21 -54.77 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 118.869 0.759 . . . . 0.0 109.444 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.24 -38.48 94.61 Favored Glycine 0 CA--C 1.531 1.035 0 CA-C-N 118.664 0.666 . . . . 0.0 111.71 -176.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.78 -49.48 58.31 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.493 1.117 . . . . 0.0 110.816 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.9 mm -55.94 -43.05 73.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 124.448 1.099 . . . . 0.0 108.989 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.3 mm-40 -70.49 -12.88 61.86 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.461 0.704 . . . . 0.0 112.061 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.26 -43.67 14.62 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 170.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.654 HD22 HG21 ' A' ' 101' ' ' ILE . 96.3 mt -70.06 -27.71 64.86 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 121.864 -0.523 . . . . 0.0 111.759 -176.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 27.9 m -57.65 -21.87 42.39 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 171.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -74.89 -22.46 58.63 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.556 1.071 . . . . 0.0 111.058 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 49.2 mt -101.98 -62.22 1.29 Allowed 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 123.872 0.869 . . . . 0.0 110.639 -177.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.37 -13.24 58.16 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.402 1.481 . . . . 0.0 113.62 -173.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 37.3 m -117.81 29.86 7.59 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.039 0.836 . . . . 0.0 110.511 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -131.98 107.99 9.05 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 123.841 0.856 . . . . 0.0 109.035 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -55.96 -34.58 65.83 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.721 1.208 . . . . 0.0 110.454 -176.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -61.79 -44.84 96.08 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.242 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.35 -44.05 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 124.372 1.069 . . . . 0.0 109.351 177.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 7.0 mp -50.52 -45.24 56.56 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 119.123 0.874 . . . . 0.0 111.506 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -68.73 -37.09 79.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.829 0.74 . . . . 0.0 110.698 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -64.69 -40.49 95.48 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 118.969 0.804 . . . . 0.0 108.913 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.3 mt -69.12 -53.38 20.5 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.0 mt -61.44 -11.85 12.23 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.232 1.013 . . . . 0.0 113.575 -174.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 70.8 p -121.87 5.83 9.91 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.593 1.157 . . . . 0.0 111.661 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.63 119.58 7.86 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 124.58 1.152 . . . . 0.0 110.539 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -76.59 -15.6 59.8 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.186 0.994 . . . . 0.0 112.345 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.4 p -153.41 163.44 39.92 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 119.077 0.853 . . . . 0.0 111.502 -172.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 51.6 mp0 -59.09 -35.86 74.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.011 0.924 . . . . 0.0 109.18 169.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -59.15 -47.08 86.62 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 122.855 0.462 . . . . 0.0 110.96 175.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.57 -34.14 77.56 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.4 mt -66.34 -46.38 77.0 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.398 0.999 . . . . 0.0 109.276 174.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.11 -31.99 73.26 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.423 0.689 . . . . 0.0 112.445 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -58.59 -36.51 74.09 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.914 -1.116 . . . . 0.0 110.987 175.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 68.2 mt -71.74 -36.47 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 C-N-CA 124.083 0.953 . . . . 0.0 109.932 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ILE . . . . . 0.486 HD11 HD22 ' A' ' 81' ' ' LEU . 50.7 mm -52.88 -52.5 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.008 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 24.8 m -69.23 -29.15 67.03 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.215 -171.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.0 ttm105 -70.07 -37.11 75.39 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 125.375 1.47 . . . . 0.0 110.628 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.166 -1.352 . . . . 0.0 111.229 177.971 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpp? . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -68.06 112.38 5.0 Favored 'General case' 0 C--N 1.341 0.225 0 N-CA-C 104.281 -2.488 . . . . 0.0 104.281 168.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -53.41 -39.01 63.98 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.321 0.648 . . . . 0.0 110.368 -175.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.7 p -53.4 -19.74 3.82 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.972 1.709 . . . . 0.0 114.066 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -60.86 -23.45 65.15 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.924 1.238 . . . . 0.0 112.706 175.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.61 -14.71 15.53 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -170.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -102.27 109.58 60.63 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 120.465 1.484 . . . . 0.0 108.079 -173.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -62.05 -70.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.042 2.495 . . . . 0.0 113.664 -173.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -163.15 -71.9 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.936 0.894 . . . . 0.0 111.637 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 m -69.86 6.4 1.21 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.69 1.196 . . . . 0.0 111.912 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -6.12 37.55 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.856 1.662 . . . . 0.0 113.593 -169.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.8 mt -122.75 130.14 74.69 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.787 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 -169.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.9 p -155.71 151.06 26.9 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.642 0.734 . . . . 0.0 111.914 -176.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.9 t -121.14 141.29 42.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 170.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.6 mt -136.58 145.99 29.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 C-N-CA 125.142 1.377 . . . . 0.0 108.214 -169.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -71.36 -38.43 71.58 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.807 -0.558 . . . . 0.0 111.699 175.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.9 p -174.33 148.15 1.23 Allowed 'General case' 0 C--O 1.237 0.403 0 N-CA-C 105.393 -2.077 . . . . 0.0 105.393 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.12 150.45 35.61 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 170.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.71 -41.55 81.98 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 176.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -157.61 169.65 24.19 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 126.78 2.032 . . . . 0.0 106.667 171.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -34.7 59.91 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.322 1.449 . . . . 0.0 112.718 169.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.465 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 26.2 mt-30 -60.64 -48.44 81.76 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.68 1.127 . . . . 0.0 109.383 170.041 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -63.5 -32.29 73.7 Favored 'General case' 0 C--O 1.223 -0.34 0 O-C-N 121.771 -0.581 . . . . 0.0 111.263 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.1 -36.29 83.09 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 121.833 -0.542 . . . . 0.0 110.059 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.99 -46.63 78.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 172.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -54.87 -45.85 74.67 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 121.751 -0.593 . . . . 0.0 110.697 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -65.32 -31.83 73.16 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 118.299 -0.858 . . . . 0.0 112.034 174.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.2 m -65.21 -20.3 66.37 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.618 1.099 . . . . 0.0 112.348 172.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.6 mmt -125.91 -20.02 4.7 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 114.919 1.452 . . . . 0.0 114.919 -168.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -60.03 -37.07 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 CA-C-N 120.714 1.597 . . . . 0.0 111.727 -169.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.3 m -65.39 -19.28 65.88 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.694 -0.629 . . . . 0.0 112.283 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 90.5 mt -91.36 -41.57 10.83 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.761 1.225 . . . . 0.0 109.144 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.6 tp -54.93 -42.68 72.55 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.007 0.923 . . . . 0.0 110.491 176.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -66.27 -28.33 68.63 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 125.312 1.445 . . . . 0.0 113.108 -173.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -99.54 18.52 17.71 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 118.241 0.473 . . . . 0.0 110.611 174.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.304 6.3 p30 46.72 38.43 5.81 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.539 1.536 . . . . 0.0 114.395 -171.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -68.42 -22.59 64.6 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.822 -1.174 . . . . 0.0 109.557 168.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.6 pt -143.43 177.24 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 126.446 1.898 . . . . 0.0 109.047 -176.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.8 m -117.16 157.46 25.91 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.603 1.961 . . . . 0.0 108.062 175.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.35 -31.79 70.65 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.026 -1.047 . . . . 0.0 112.94 -172.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -58.21 -33.24 69.08 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.887 -0.508 . . . . 0.0 111.878 175.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -60.09 -44.47 94.78 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.459 0.704 . . . . 0.0 110.494 -176.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -58.2 -50.94 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 174.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.0 tp60 -68.89 -26.17 64.98 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.412 -0.804 . . . . 0.0 112.058 -174.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.55 -43.64 89.39 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.493 1.042 . . . . 0.0 110.508 173.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 43.1 mt -68.3 -49.22 68.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.4 mttt -57.86 -42.51 84.63 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -61.35 -51.36 69.14 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.69 0.796 . . . . 0.0 111.242 -173.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 41.4 m -64.98 -39.9 94.16 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 118.306 0.503 . . . . 0.0 110.552 176.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 88.3 m -55.74 -41.35 73.79 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.964 0.506 . . . . 0.0 111.388 176.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 78.9 mt -76.16 -49.01 26.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 118.872 0.76 . . . . 0.0 109.993 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -72.45 -32.3 66.16 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -169.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -127.36 -46.42 1.48 Allowed 'General case' 0 C--O 1.231 0.113 0 C-N-CA 123.826 0.85 . . . . 0.0 110.642 -169.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 139.61 163.42 9.5 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 108.448 -1.861 . . . . 0.0 108.448 -176.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -62.55 149.17 91.94 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 121.75 1.633 . . . . 0.0 109.149 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -131.72 10.93 4.76 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 -169.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -133.6 87.64 2.4 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 169.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 39.3 mm -136.22 136.01 49.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 104.919 -2.252 . . . . 0.0 104.919 -174.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -122.89 -30.65 3.78 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 123.215 0.606 . . . . 0.0 110.893 -170.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.57 157.94 27.08 Favored Pre-proline 0 N--CA 1.452 -0.343 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 173.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -51.99 120.02 6.56 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.026 1.818 . . . . 0.0 109.139 169.527 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 102.81 -15.68 55.31 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-O 117.942 -1.477 . . . . 0.0 114.117 -178.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 98.0 t -129.11 119.52 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 119.769 1.785 . . . . 0.0 109.538 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -116.49 166.85 11.61 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.689 1.596 . . . . 0.0 109.385 173.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 13.5 ttm -137.37 60.68 28.11 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.667 175.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -49.7 137.13 34.36 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 122.277 1.985 . . . . 0.0 113.98 -172.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -177.63 153.12 0.85 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 128.45 2.7 . . . . 0.0 106.706 -169.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.35 161.07 36.01 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 126.392 1.877 . . . . 0.0 107.459 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -53.63 143.14 39.68 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-O 117.651 -1.166 . . . . 0.0 108.876 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -46.83 -41.28 25.22 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.643 2.895 . . . . 0.0 113.246 -177.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -58.68 -14.72 9.17 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.601 1.56 . . . . 0.0 114.134 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 61.8 m -77.9 -4.61 47.62 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.66 0.784 . . . . 0.0 111.663 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 131.48 14.36 1.75 Allowed Glycine 0 C--N 1.337 0.597 0 CA-C-O 118.039 -1.423 . . . . 0.0 113.244 172.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.18 145.01 56.29 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 119.693 1.747 . . . . 0.0 109.289 169.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.5 mt -128.48 -34.82 2.0 Allowed 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.937 1.295 . . . . 0.0 110.291 -173.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -142.47 163.85 31.71 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 126.111 1.764 . . . . 0.0 108.026 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.1 m -97.49 130.79 44.54 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.187 0.595 . . . . 0.0 110.507 -176.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -173.74 179.48 45.09 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.742 1.163 . . . . 0.0 111.211 -176.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.633 ' SD ' HD21 ' A' ' 118' ' ' LEU . 56.4 mtt -144.89 167.85 21.64 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.168 1.387 . . . . 0.0 112.059 -172.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.3 m -138.33 166.16 24.91 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.076 1.75 . . . . 0.0 108.918 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.55 HD22 HD11 ' A' ' 144' ' ' ILE . 49.8 tp -147.85 85.47 1.55 Allowed 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.767 1.627 . . . . 0.0 108.025 -171.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.1 m -104.62 135.11 46.64 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.429 HD13 HD13 ' A' ' 99' ' ' LEU . 14.1 tp -129.58 142.62 50.71 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 173.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.6 mp -122.4 132.72 54.5 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.784 1.634 . . . . 0.0 106.795 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.0 -48.14 72.17 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 123.135 0.574 . . . . 0.0 110.237 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -90.43 -13.76 34.25 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.742 0.817 . . . . 0.0 112.317 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 64.31 -176.44 10.18 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 110.691 -0.963 . . . . 0.0 110.691 -168.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -148.53 167.8 3.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 169.272 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -120.3 96.6 5.21 Favored 'General case' 0 C--N 1.334 -0.079 0 O-C-N 121.643 -0.661 . . . . 0.0 110.699 -169.149 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -53.14 136.01 49.18 Favored Pre-proline 0 CA--C 1.538 0.487 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.626 169.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -62.12 129.79 28.41 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.057 1.838 . . . . 0.0 110.715 -173.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 70.65 9.58 65.61 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-O 118.365 -1.242 . . . . 0.0 114.562 174.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -72.42 168.83 17.63 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.901 1.851 . . . . 0.0 110.736 174.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.26 -38.1 89.27 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.03 163.29 24.45 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.545 1.538 . . . . 0.0 109.299 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.33 158.43 31.14 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.469 2.113 . . . . 0.0 112.25 173.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 36.3 mm -111.04 136.34 47.4 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -177.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -108.74 -14.42 14.6 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 117.118 -1.42 . . . . 0.0 110.988 173.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.429 HD13 HD13 ' A' ' 83' ' ' LEU . 14.1 tp -139.3 136.25 34.67 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 120.854 1.661 . . . . 0.0 110.787 -175.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.6 mp -139.1 95.5 2.95 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 -172.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.665 HG21 HD22 ' A' ' 118' ' ' LEU . 1.7 mp -76.69 118.7 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 106.326 -1.731 . . . . 0.0 106.326 169.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -77.95 150.11 35.41 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 170.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.432 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -146.41 139.03 25.28 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 169.0 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.432 ' N ' HD23 ' A' ' 103' ' ' LEU . 4.0 m -142.5 144.93 33.2 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 169.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.16 138.96 25.57 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -170.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -78.9 -23.28 44.88 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.818 0.447 . . . . 0.0 111.982 -175.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -143.68 155.51 44.25 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.838 0.855 . . . . 0.0 109.825 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.93 -35.66 73.47 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.648 0.779 . . . . 0.0 113.013 -177.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -76.14 -32.32 59.05 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.059 -1.026 . . . . 0.0 111.173 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.9 m -62.31 -41.57 98.63 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 169.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -57.88 -50.03 74.7 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.229 1.011 . . . . 0.0 110.056 172.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.0 mm -56.16 -54.34 28.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 118.709 0.686 . . . . 0.0 109.412 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.41 -39.4 96.18 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-N 118.775 0.716 . . . . 0.0 111.561 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.54 -49.62 62.45 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.183 0.993 . . . . 0.0 110.819 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.5 mm -55.63 -44.01 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.548 1.139 . . . . 0.0 108.974 176.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -70.72 -12.39 61.53 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.54 0.736 . . . . 0.0 112.032 -178.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.51 -45.21 13.83 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 170.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.665 HD22 HG21 ' A' ' 101' ' ' ILE . 94.7 mt -69.84 -28.64 65.85 Favored 'General case' 0 CA--C 1.515 -0.371 0 O-C-N 121.919 -0.488 . . . . 0.0 111.732 -176.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.0 m -60.91 -20.76 62.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.241 0.616 . . . . 0.0 112.33 171.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -71.6 -22.57 61.7 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.672 1.124 . . . . 0.0 110.4 174.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 45.4 mt -103.3 -64.67 1.06 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.157 0.983 . . . . 0.0 110.284 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.402 HD11 ' HB ' ' A' ' 101' ' ' ILE . 19.2 mt -73.46 1.21 10.29 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -170.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.0 m -121.73 27.78 7.99 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.118 0.967 . . . . 0.0 110.954 174.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -139.4 95.96 3.02 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 -170.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.2 -25.53 33.51 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.131 0.972 . . . . 0.0 112.618 -172.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -63.51 -44.18 95.05 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 123.064 0.546 . . . . 0.0 110.076 175.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.3 -40.82 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 C-N-CA 125.087 1.355 . . . . 0.0 109.887 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 6.8 mp -51.41 -43.39 61.95 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 119.712 1.142 . . . . 0.0 111.678 -178.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -69.93 -36.81 75.61 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.75 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -63.76 -41.55 97.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 119.107 0.867 . . . . 0.0 108.831 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 6.8 mt -67.17 -52.93 35.34 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 60.9 mt -62.38 -14.68 42.69 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 63.5 p -116.87 5.48 12.99 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.391 1.076 . . . . 0.0 111.83 178.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.38 115.74 3.46 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.14 0.976 . . . . 0.0 109.37 177.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.5 m -87.96 -4.79 58.78 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.206 1.002 . . . . 0.0 111.933 -177.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.6 p -152.84 163.08 40.42 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.547 0.739 . . . . 0.0 110.08 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 58.8 mp0 -58.32 -37.64 75.52 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 123.943 0.897 . . . . 0.0 109.819 169.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -58.05 -45.97 86.17 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-O 119.359 -0.353 . . . . 0.0 110.356 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -65.38 -26.55 68.05 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 118.608 -0.71 . . . . 0.0 112.905 177.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 49.5 mt -72.69 -48.29 40.19 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 120.305 1.412 . . . . 0.0 109.0 172.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.09 -26.84 69.02 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 177.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -58.73 -37.97 77.34 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.007 -1.058 . . . . 0.0 110.607 172.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 67.6 mt -74.29 -36.26 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 124.018 0.927 . . . . 0.0 109.512 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ILE . . . . . 0.55 HD11 HD22 ' A' ' 81' ' ' LEU . 33.3 mm -55.16 -48.93 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 169.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.2 m -67.91 -26.62 66.07 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.367 -171.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 23.7 ttm105 -79.27 -16.03 57.06 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 126.852 2.061 . . . . 0.0 111.728 177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.91 0 N-CA-C 108.688 -1.765 . . . . 0.0 108.688 174.569 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tpt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.564 0.221 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -65.47 116.9 7.23 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.54 HD23 ' HA3' ' A' ' 147' ' ' GLY . 4.0 mm? -59.15 -39.05 81.23 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.651 0.78 . . . . 0.0 110.023 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.9 p -59.55 -14.97 15.2 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 124.937 1.295 . . . . 0.0 112.025 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -84.0 -27.14 28.63 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 123.951 0.901 . . . . 0.0 113.404 174.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -96.95 -39.01 9.58 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 122.889 0.476 . . . . 0.0 111.393 -174.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.43 ' CE2' HD11 ' A' ' 12' ' ' ILE . 0.1 OUTLIER -89.03 127.02 57.22 Favored Pre-proline 0 CA--C 1.551 0.997 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -173.519 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -69.44 -76.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 122.552 2.168 . . . . 0.0 113.131 -170.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' A' ' 11' ' ' SER . 32.1 tt0 -166.39 -62.08 0.03 OUTLIER 'General case' 0 C--O 1.231 0.107 0 C-N-CA 125.317 1.447 . . . . 0.0 109.886 -177.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.04 11.75 0.28 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.93 1.692 . . . . 0.0 112.149 175.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.422 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -68.87 -23.33 64.2 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 126.938 2.095 . . . . 0.0 111.429 -169.642 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.447 HG13 ' HB2' ' A' ' 141' ' ' ALA . 13.6 mm -98.99 139.34 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.298 0 C-N-CA 124.604 1.161 . . . . 0.0 108.016 -169.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 m -158.91 128.46 5.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 118.398 0.545 . . . . 0.0 109.857 169.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 p -96.74 142.94 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 105.613 -1.995 . . . . 0.0 105.613 168.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 15' ' ' ILE . 21.4 mt -138.31 148.61 24.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 -169.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -65.72 -48.72 71.01 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.451 -0.781 . . . . 0.0 110.309 169.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -169.67 148.46 3.66 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 105.334 -2.099 . . . . 0.0 105.334 -178.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.34 153.47 42.33 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 171.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -54.49 -43.23 71.61 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.381 0.673 . . . . 0.0 110.093 173.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -163.58 177.07 9.08 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 126.938 2.095 . . . . 0.0 107.765 169.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -54.81 -36.39 64.91 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 126.285 1.834 . . . . 0.0 113.937 175.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.408 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.8 mt-30 -62.52 -49.79 73.94 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 120.328 1.422 . . . . 0.0 108.459 171.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -60.65 -31.46 70.68 Favored 'General case' 0 C--O 1.222 -0.362 0 O-C-N 122.067 -0.396 . . . . 0.0 111.833 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.57 83.17 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.473 -0.767 . . . . 0.0 110.221 -178.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.3 -45.06 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 169.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -57.4 -46.56 83.33 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 122.959 0.503 . . . . 0.0 110.163 -176.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -63.43 -36.15 82.78 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.976 1.31 . . . . 0.0 111.771 172.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.5 m -62.66 -21.38 65.67 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.636 1.107 . . . . 0.0 112.504 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.7 mmt -122.43 -18.82 6.6 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -169.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.7 p -60.88 -35.92 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 121.152 1.796 . . . . 0.0 111.74 -171.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -67.16 -21.58 65.8 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.968 0.804 . . . . 0.0 111.998 179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.8 mt -83.41 -43.97 15.31 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.166 0.986 . . . . 0.0 108.658 171.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 34.2 tp -57.19 -42.85 82.01 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.331 1.052 . . . . 0.0 111.038 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.91 -30.14 67.6 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 126.271 1.829 . . . . 0.0 113.256 -176.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -108.93 20.73 18.11 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.377 0.0 OUTLIER 42.4 38.48 1.22 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.379 2.272 . . . . 0.0 115.38 -172.533 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -66.19 -21.18 66.31 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.416 -0.802 . . . . 0.0 110.081 168.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.1 pt -149.05 175.91 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 127.074 2.15 . . . . 0.0 108.488 -173.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.5 p -113.58 166.33 11.63 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.458 1.503 . . . . 0.0 108.486 169.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.46 -28.16 69.78 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.023 -1.048 . . . . 0.0 111.327 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -61.49 -38.08 86.0 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 121.679 -0.638 . . . . 0.0 111.301 176.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -57.11 -48.0 79.7 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.607 0.763 . . . . 0.0 109.85 178.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.0 mt -59.04 -50.39 79.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 124.99 1.316 . . . . 0.0 109.04 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -68.05 -27.34 66.43 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.954 -174.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.96 -43.38 86.42 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.4 1.0 . . . . 0.0 110.651 172.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 18.3 mt -68.06 -49.39 68.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.408 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 86.3 mttt -60.24 -47.09 87.46 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -174.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.64 -44.17 94.63 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.607 0.763 . . . . 0.0 110.923 -175.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.6 m -63.01 -44.5 95.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.989 0.516 . . . . 0.0 110.02 175.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.9 m -57.75 -40.66 80.22 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.759 0.824 . . . . 0.0 111.516 176.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 74.1 mt -68.55 -47.82 75.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 119.325 0.966 . . . . 0.0 109.837 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -78.22 -31.16 49.19 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -122.72 -8.25 8.47 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.674 1.19 . . . . 0.0 112.505 -169.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 85.44 166.55 42.08 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 107.968 -2.053 . . . . 0.0 107.968 -168.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -63.59 148.83 92.14 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 CA-C-N 119.403 1.602 . . . . 0.0 109.695 -179.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -134.29 17.47 3.72 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.481 -169.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -140.37 77.18 1.59 Allowed 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 126.669 1.987 . . . . 0.0 107.329 175.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 50.1 mm -128.58 143.64 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 105.494 -2.039 . . . . 0.0 105.494 -177.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 mp -132.02 -31.51 1.48 Allowed 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -169.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -163.53 163.45 16.38 Favored Pre-proline 0 C--O 1.236 0.351 0 C-N-CA 124.881 1.272 . . . . 0.0 107.596 -175.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.25 112.01 0.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.25 2.633 . . . . 0.0 111.846 171.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.17 4.69 77.54 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-O 117.471 -1.738 . . . . 0.0 114.618 176.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.49 126.89 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 119.977 1.889 . . . . 0.0 109.572 -169.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.76 171.01 12.11 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 125.879 1.672 . . . . 0.0 109.875 177.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.587 ' HE2' HD12 ' A' ' 122' ' ' LEU . 9.1 ttm -146.72 66.17 10.53 Favored Pre-proline 0 CA--C 1.54 0.578 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -50.67 137.05 42.08 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 121.178 1.252 . . . . 0.0 112.972 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -177.56 155.75 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 129.776 3.23 . . . . 0.0 105.279 -170.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.11 163.44 30.81 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.557 1.143 . . . . 0.0 108.336 171.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -52.11 139.08 35.22 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-O 118.024 -0.988 . . . . 0.0 109.413 175.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -44.67 -47.91 10.98 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.961 3.107 . . . . 0.0 113.335 -177.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -69.11 -4.26 16.56 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -175.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 73.7 m -78.94 -4.32 49.27 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.233 -0.917 . . . . 0.0 111.976 172.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 136.62 13.64 0.96 Allowed Glycine 0 CA--C 1.526 0.747 0 CA-C-N 119.485 1.039 . . . . 0.0 114.135 174.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.73 147.74 52.23 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 119.566 1.683 . . . . 0.0 108.804 169.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.2 mt -131.23 -31.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.65 1.18 . . . . 0.0 110.197 -175.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -144.91 154.61 42.79 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.311 1.444 . . . . 0.0 108.522 175.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 37.5 m -86.64 129.68 34.78 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 123.394 0.678 . . . . 0.0 109.886 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.23 -175.75 38.72 Favored Glycine 0 CA--C 1.527 0.808 0 C-N-CA 123.816 0.722 . . . . 0.0 111.313 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 49.5 mtp -145.09 170.14 16.77 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.242 1.417 . . . . 0.0 110.844 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 33.0 m -157.27 173.34 17.09 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.165 1.786 . . . . 0.0 108.701 170.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.3 tp -148.21 116.45 6.51 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.071 1.348 . . . . 0.0 110.904 -168.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 87.8 m -118.37 143.68 46.47 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 125.081 1.352 . . . . 0.0 108.746 -177.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -134.85 143.44 47.01 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 171.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.4 mp -121.72 133.08 54.94 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.124 1.77 . . . . 0.0 106.313 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -67.14 -48.04 69.24 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.793 -0.567 . . . . 0.0 110.913 177.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -88.1 -15.95 34.83 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.555 0.742 . . . . 0.0 112.001 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.92 -178.21 21.27 Favored Glycine 0 CA--C 1.532 1.1 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -168.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -145.32 167.57 9.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 169.255 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -121.5 93.35 3.98 Favored 'General case' 0 C--N 1.333 -0.12 0 O-C-N 121.805 -0.56 . . . . 0.0 110.799 -169.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -48.88 138.64 12.53 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 123.743 0.817 . . . . 0.0 110.616 169.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -62.93 133.35 41.1 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 122.342 2.028 . . . . 0.0 110.827 -172.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 70.82 5.84 58.22 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-O 118.244 -1.309 . . . . 0.0 114.741 172.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -73.3 168.9 18.22 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 120.07 1.935 . . . . 0.0 110.05 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -67.55 -37.43 82.67 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.552 -0.717 . . . . 0.0 111.824 176.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -155.25 167.39 14.22 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.383 1.073 . . . . 0.0 111.942 -170.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -74.89 159.81 41.24 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 123.045 2.496 . . . . 0.0 111.7 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.7 mm -113.49 138.32 43.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 21.3 mtpp -112.05 -19.63 12.25 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 117.291 -1.338 . . . . 0.0 111.03 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.6 tp -133.66 131.71 39.85 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 120.218 1.372 . . . . 0.0 109.424 -170.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.6 mp -138.4 135.1 34.94 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -175.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.438 ' HB ' HD11 ' A' ' 122' ' ' LEU . 2.0 mt -113.12 127.84 70.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 169.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.22 145.89 25.91 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 107.634 -2.186 . . . . 0.0 107.634 169.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.402 HD12 HD23 ' A' ' 118' ' ' LEU . 6.9 tt -143.62 132.6 22.84 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 169.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 85.3 p -124.39 153.39 41.94 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 169.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -152.87 133.06 13.51 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 118.343 0.52 . . . . 0.0 110.189 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.24 -22.06 58.16 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.024 0.53 . . . . 0.0 111.938 177.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -148.65 156.32 42.24 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.311 1.044 . . . . 0.0 109.642 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.41 -34.49 72.53 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -177.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.64 -30.94 61.8 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 120.749 -1.219 . . . . 0.0 111.065 177.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.1 m -67.16 -37.1 83.19 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.632 -0.668 . . . . 0.0 110.342 171.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -59.04 -49.02 79.48 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 123.857 0.863 . . . . 0.0 109.585 170.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 14.7 mm -54.29 -49.62 62.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 176.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.16 -42.79 97.32 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-N 119.199 0.908 . . . . 0.0 112.478 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.42 -40.47 67.09 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.398 0.679 . . . . 0.0 111.199 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.455 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 8.4 mm -58.03 -47.0 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 C-N-CA 125.391 1.477 . . . . 0.0 107.501 173.134 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -67.74 0.15 3.55 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.347 1.459 . . . . 0.0 112.661 178.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -100.3 -54.76 2.78 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 124.824 1.25 . . . . 0.0 107.868 169.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.457 HD12 ' N ' ' A' ' 119' ' ' SER . 1.4 pp -64.43 -21.68 66.72 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -178.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.457 ' N ' HD12 ' A' ' 118' ' ' LEU . 54.5 p -59.39 -30.39 68.41 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 123.62 0.768 . . . . 0.0 111.844 175.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -70.14 -11.15 60.68 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.545 -0.722 . . . . 0.0 110.975 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.517 ' HA ' HG21 ' A' ' 127' ' ' ILE . 35.2 mt -110.64 -63.62 1.37 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.115 0.966 . . . . 0.0 111.008 176.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.587 HD12 ' HE2' ' A' ' 65' ' ' MET . 17.1 mt -70.6 -17.3 62.9 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -172.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.1 m -111.85 27.78 9.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.597 0.759 . . . . 0.0 110.402 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -132.8 97.7 4.11 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 107.227 -1.397 . . . . 0.0 107.227 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -57.85 -28.33 64.02 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.232 -175.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -67.27 -42.55 83.68 Favored 'General case' 0 C--O 1.23 0.072 0 CA-C-O 121.303 0.573 . . . . 0.0 109.772 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.517 HG21 ' HA ' ' A' ' 121' ' ' LEU . 1.2 mp -69.05 -42.94 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.484 HD21 ' HA ' ' A' ' 122' ' ' LEU . 40.2 mt -54.09 -44.98 71.66 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 118.893 -0.575 . . . . 0.0 111.061 -175.817 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -69.7 -34.99 74.69 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 118.244 0.475 . . . . 0.0 110.109 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -72.28 -35.22 68.66 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.946 0.794 . . . . 0.0 109.883 -177.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 28.9 mt -67.28 -52.15 44.16 Favored 'General case' 0 C--O 1.225 -0.203 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 170.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.4 -24.66 56.79 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 66.9 p -105.46 5.33 31.49 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.737 1.215 . . . . 0.0 112.122 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -56.5 116.45 3.11 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 119.181 0.9 . . . . 0.0 110.413 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.3 m -68.63 -29.39 67.88 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 125.354 1.462 . . . . 0.0 111.342 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 33.1 m -147.68 164.33 33.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.971 1.309 . . . . 0.0 109.855 -169.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -54.6 -39.08 67.49 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.14 1.376 . . . . 0.0 110.389 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -56.08 -39.89 72.8 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.939 0.896 . . . . 0.0 112.389 -176.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -61.45 -43.99 97.89 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 118.824 0.738 . . . . 0.0 110.851 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.6 mt -62.87 -49.54 74.43 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -178.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.447 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -60.05 -27.89 67.33 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 174.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -81.24 -39.43 25.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 119.05 0.841 . . . . 0.0 110.6 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 63.4 mt -66.95 -33.0 60.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 123.958 0.903 . . . . 0.0 109.253 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 1.1 mm -48.37 -47.77 14.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.75 1.22 . . . . 0.0 111.287 169.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 16.3 m -66.18 -18.61 65.45 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.789 0.836 . . . . 0.0 112.562 -169.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 32.1 ttp85 -53.82 -35.67 61.68 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.696 1.198 . . . . 0.0 112.93 173.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' GLY . . . . . 0.54 ' HA3' HD23 ' A' ' 3' ' ' LEU . . . . . . . . 0 C--O 1.247 0.953 0 N-CA-C 107.876 -2.09 . . . . 0.0 107.876 -173.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.872 0.367 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.44 ' HD2' ' HA ' ' A' ' 2' ' ' ARG . 6.3 mmm180 -68.12 114.18 6.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.164 -175.018 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.0 -34.35 74.67 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.754 175.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.1 m -55.16 -15.92 2.68 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.0 0.818 . . . . 0.0 113.079 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -62.38 -23.32 66.74 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 172.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -106.5 -19.1 13.78 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -169.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -105.58 100.46 26.79 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 120.657 1.571 . . . . 0.0 107.589 -169.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -59.51 -67.41 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.462 2.775 . . . . 0.0 114.135 -170.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -162.26 -72.98 0.05 Allowed 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 123.78 0.832 . . . . 0.0 111.485 -174.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.7 m -67.75 2.6 1.83 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.559 1.144 . . . . 0.0 112.009 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.52 -14.84 63.28 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.825 1.65 . . . . 0.0 112.745 -169.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.4 mt -117.8 130.35 72.81 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 105.123 -2.177 . . . . 0.0 105.123 -169.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 75.8 m -156.9 149.38 23.31 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.51 0.671 . . . . 0.0 111.231 -177.675 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.4 t -117.96 141.38 37.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 105.632 -1.988 . . . . 0.0 105.632 169.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.2 mt -135.37 145.01 32.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 125.602 1.561 . . . . 0.0 107.767 -169.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -68.19 -36.3 79.37 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.878 -0.514 . . . . 0.0 111.909 176.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 p -179.54 146.61 0.28 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.802 2.041 . . . . 0.0 106.346 -177.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.79 154.12 36.47 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 169.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.53 -42.94 83.89 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.215 0.606 . . . . 0.0 109.778 174.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -166.07 177.88 6.72 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 128.34 2.656 . . . . 0.0 107.29 172.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.46 -37.49 65.27 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 126.352 1.861 . . . . 0.0 114.015 175.354 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.446 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.1 mt-30 -62.03 -50.4 72.17 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.316 1.416 . . . . 0.0 108.364 172.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -60.04 -31.33 69.86 Favored 'General case' 0 C--O 1.222 -0.348 0 O-C-N 122.039 -0.413 . . . . 0.0 111.808 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.24 -38.01 84.48 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.582 -0.699 . . . . 0.0 110.234 -179.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.9 -45.35 91.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 169.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -56.69 -44.87 81.92 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 122.696 0.398 . . . . 0.0 110.208 -176.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -69.42 -28.29 66.01 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.758 1.223 . . . . 0.0 112.466 174.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m -64.71 -20.94 66.61 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.953 1.251 . . . . 0.0 111.53 170.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.4 mmt -122.69 -21.47 5.63 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -169.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -59.26 -35.27 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 120.944 1.702 . . . . 0.0 112.16 -169.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.5 m -64.43 -30.97 72.0 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.039 0.836 . . . . 0.0 111.417 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.7 mt -77.41 -43.22 33.33 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.807 0.843 . . . . 0.0 108.821 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 28.3 tp -56.67 -41.42 77.22 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.825 0.85 . . . . 0.0 110.956 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.61 -29.1 68.35 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 124.992 1.317 . . . . 0.0 112.78 -171.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -99.71 16.45 23.49 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.09 0.405 . . . . 0.0 110.654 172.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.336 3.4 p30 44.9 46.54 9.02 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.969 1.708 . . . . 0.0 114.167 -171.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -72.73 -19.96 61.29 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.596 -0.69 . . . . 0.0 109.14 167.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 pt -142.36 172.99 7.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 127.242 2.217 . . . . 0.0 108.531 -178.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m -108.23 159.03 16.94 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.165 1.786 . . . . 0.0 108.195 170.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -60.75 -33.72 73.36 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.86 -1.15 . . . . 0.0 111.74 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -62.34 -25.63 68.0 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.273 -0.892 . . . . 0.0 113.091 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -63.3 -45.73 90.01 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 119.521 1.055 . . . . 0.0 109.591 174.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.7 mt -59.9 -51.26 74.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 124.75 1.22 . . . . 0.0 108.816 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -68.75 -24.54 64.46 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.718 -174.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.5 -42.52 82.92 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.661 1.119 . . . . 0.0 110.765 172.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 14.9 mt -69.86 -49.22 58.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.446 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.8 mttt -59.81 -42.16 92.83 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -174.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -60.42 -48.07 83.37 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.734 0.814 . . . . 0.0 111.532 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.6 m -62.55 -43.32 99.1 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.309 0.504 . . . . 0.0 110.456 176.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 42.1 m -58.97 -41.75 88.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.527 0.731 . . . . 0.0 111.29 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 65.3 mt -69.6 -41.33 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.188 0.995 . . . . 0.0 109.796 177.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.48 -34.39 76.75 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.597 0.759 . . . . 0.0 112.777 -170.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -149.63 -52.96 0.16 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.232 0.613 . . . . 0.0 110.622 -168.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.15 174.49 32.11 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 108.691 -1.764 . . . . 0.0 108.691 178.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -50.36 152.21 8.79 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 123.199 2.599 . . . . 0.0 113.583 175.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -118.34 3.93 11.89 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.488 1.115 . . . . 0.0 111.5 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -139.5 67.03 1.39 Allowed 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 124.689 1.196 . . . . 0.0 109.311 -169.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.5 mm -118.02 138.71 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -124.18 -33.36 3.09 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.255 0.622 . . . . 0.0 112.183 -169.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.51 164.19 20.0 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 124.844 1.258 . . . . 0.0 107.794 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -46.32 112.72 0.5 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.412 2.741 . . . . 0.0 111.997 172.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.41 5.38 85.04 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-O 117.792 -1.56 . . . . 0.0 114.677 176.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.9 t -127.26 122.92 60.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 120.066 1.933 . . . . 0.0 108.896 -169.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.71 171.1 10.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.802 1.641 . . . . 0.0 109.998 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.492 ' CE ' HD11 ' A' ' 118' ' ' LEU . 9.1 ttm -141.31 58.76 9.31 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 123.997 0.919 . . . . 0.0 111.516 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -56.32 128.12 28.83 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 121.807 1.671 . . . . 0.0 110.535 -176.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -179.11 162.69 1.24 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 127.809 2.444 . . . . 0.0 106.719 -169.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.83 171.79 13.91 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.791 1.237 . . . . 0.0 109.237 -175.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 -57.71 154.09 27.94 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-O 118.375 -0.822 . . . . 0.0 109.632 171.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.38 -40.17 83.74 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.499 2.132 . . . . 0.0 109.488 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.67 -16.97 30.29 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.948 2.099 . . . . 0.0 113.179 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 84.2 m -77.1 -9.41 58.72 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.736 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 135.78 17.26 0.84 Allowed Glycine 0 C--N 1.34 0.775 0 CA-C-O 118.234 -1.315 . . . . 0.0 113.859 175.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 148.42 51.78 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.435 1.617 . . . . 0.0 109.358 172.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.8 mt -129.24 -33.98 1.89 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 124.459 1.103 . . . . 0.0 110.685 -175.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -146.7 159.78 43.04 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.267 1.427 . . . . 0.0 108.524 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 85.2 m -92.47 125.47 37.13 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 123.379 0.672 . . . . 0.0 111.986 -175.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.62 -178.5 42.77 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 125.104 1.335 . . . . 0.0 111.294 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 13.1 mtm -147.36 169.79 18.71 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.962 1.705 . . . . 0.0 111.778 -176.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -136.88 161.02 37.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.503 1.921 . . . . 0.0 108.829 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 33.4 tp -143.03 106.28 4.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.818 2.047 . . . . 0.0 108.122 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.1 m -121.41 136.21 54.98 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -170.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tt -132.99 136.57 46.13 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 119.348 0.977 . . . . 0.0 108.404 175.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.0 mp -113.95 126.74 55.49 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 125.54 1.536 . . . . 0.0 107.311 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -61.78 -40.77 96.33 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.323 0.649 . . . . 0.0 110.892 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -96.35 -10.75 27.03 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.829 0.851 . . . . 0.0 112.175 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 61.3 -173.74 6.53 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -169.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -150.27 168.27 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 168.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -125.94 92.42 3.59 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 121.5 0.666 . . . . 0.0 110.203 -170.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -49.0 140.49 11.43 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.337 171.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -62.65 141.29 85.2 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.18 1.92 . . . . 0.0 110.081 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 73.7 -5.63 22.49 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 118.169 -1.351 . . . . 0.0 114.978 172.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -75.99 166.22 23.81 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.252 2.026 . . . . 0.0 110.056 175.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -70.98 -35.42 72.12 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.61 -0.681 . . . . 0.0 112.329 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -153.34 168.05 12.32 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 123.974 0.91 . . . . 0.0 112.161 -169.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -73.68 159.5 45.58 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.819 2.346 . . . . 0.0 111.453 178.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.0 mm -113.55 137.4 46.79 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -114.01 -15.13 12.35 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 116.519 -1.705 . . . . 0.0 111.146 175.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.514 HD13 HD13 ' A' ' 131' ' ' LEU . 0.6 OUTLIER -138.73 144.06 39.33 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 121.249 1.841 . . . . 0.0 111.982 175.171 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -139.37 109.79 6.57 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.654 1.582 . . . . 0.0 107.386 -173.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.457 ' HB ' HD11 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -84.9 135.6 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 168.865 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -97.88 154.81 20.32 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 109.218 -1.553 . . . . 0.0 109.218 170.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.519 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -152.11 144.54 24.1 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 173.511 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.519 ' N ' HD23 ' A' ' 103' ' ' LEU . 82.5 p -142.53 145.05 33.23 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 168.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.643 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -144.1 146.91 33.11 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 119.27 0.941 . . . . 0.0 109.642 169.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.01 -14.56 59.12 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.483 -176.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -136.97 151.0 48.51 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.436 0.694 . . . . 0.0 110.202 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.43 -35.38 77.4 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -72.6 -30.39 64.32 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 121.139 -0.976 . . . . 0.0 110.917 176.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.43 ' HB2' ' HB1' ' A' ' 105' ' ' ALA . 19.6 m -66.46 -36.45 82.81 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.383 169.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.643 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 27.3 m-70 -61.55 -45.79 92.66 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 119.303 0.956 . . . . 0.0 109.969 170.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 20.8 mm -55.7 -51.76 55.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 118.985 0.811 . . . . 0.0 109.274 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.26 -41.8 96.97 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-N 118.854 0.752 . . . . 0.0 111.669 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.37 -43.68 73.08 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.492 0.717 . . . . 0.0 111.22 -179.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.8 mm -59.11 -46.47 91.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 C-N-CA 124.847 1.259 . . . . 0.0 108.282 175.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -68.03 -12.05 60.1 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.352 -0.843 . . . . 0.0 111.562 -178.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -91.52 -50.16 5.93 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 124.216 1.006 . . . . 0.0 109.089 173.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.492 HD11 ' CE ' ' A' ' 65' ' ' MET . 4.2 pp -69.01 -26.81 65.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 121.69 -0.631 . . . . 0.0 111.478 -176.349 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.8 m -62.16 -22.18 65.66 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 119.118 -0.467 . . . . 0.0 112.168 173.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -65.97 -16.7 64.12 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.396 0.998 . . . . 0.0 110.336 172.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 34.1 mt -106.3 -60.91 1.59 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.612 1.565 . . . . 0.0 110.115 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.488 HD12 ' HE2' ' A' ' 65' ' ' MET . 13.6 mt -69.15 -17.51 63.83 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -173.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 44.3 m -113.03 27.38 9.67 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 119.046 0.839 . . . . 0.0 110.595 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -139.31 96.87 3.17 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 -170.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.44 -25.77 38.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.296 1.038 . . . . 0.0 112.737 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.34 -45.8 89.54 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.373 0.606 . . . . 0.0 109.896 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -72.15 -38.21 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.3 mt -59.06 -33.37 70.71 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 119.312 0.96 . . . . 0.0 111.468 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -68.27 -43.34 78.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 120.858 -1.151 . . . . 0.0 110.334 172.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -64.73 -33.36 75.78 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.599 0.636 . . . . 0.0 110.665 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.514 HD13 HD13 ' A' ' 99' ' ' LEU . 2.6 pp -78.11 -45.41 23.44 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.119 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 53.8 mt -62.97 -24.03 67.7 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 120.225 1.375 . . . . 0.0 112.395 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 52.4 p -94.36 1.0 55.89 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.984 0.914 . . . . 0.0 111.646 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.96 107.67 2.76 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.131 0.878 . . . . 0.0 110.944 -176.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.2 p -77.42 -24.24 50.47 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.776 1.23 . . . . 0.0 112.208 176.188 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 29.8 m -147.55 157.47 43.57 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.86 0.864 . . . . 0.0 111.32 -169.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -50.04 -42.25 49.22 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.963 2.105 . . . . 0.0 111.643 177.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -70.57 -21.97 62.63 Favored 'General case' 0 CA--C 1.527 0.081 0 O-C-N 121.452 -0.78 . . . . 0.0 112.559 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -76.42 -32.2 58.36 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 120.163 1.347 . . . . 0.0 109.468 173.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.48 -43.42 76.99 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.269 -0.894 . . . . 0.0 108.642 174.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -56.44 -38.93 72.29 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 170.192 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.18 -39.01 91.29 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 119.154 0.888 . . . . 0.0 111.191 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 86.4 mt -62.03 -43.48 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.453 0.701 . . . . 0.0 109.578 175.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 18.0 mm -58.92 -43.56 88.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 C-N-CA 122.792 0.437 . . . . 0.0 110.299 176.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 52.3 m -72.67 -26.75 61.74 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 122.017 -0.427 . . . . 0.0 111.831 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 -70.06 -40.43 75.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.305 1.042 . . . . 0.0 110.049 174.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 C-N-CA 124.639 1.114 . . . . 0.0 110.477 -174.623 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 N--CA 1.485 1.312 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -62.31 113.08 2.7 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 168.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -53.49 -43.34 68.16 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.146 0.978 . . . . 0.0 108.794 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -54.05 -21.62 8.81 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.158 1.383 . . . . 0.0 113.69 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.99 -26.12 68.03 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.73 1.15 . . . . 0.0 112.659 173.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -97.85 -22.33 16.42 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 118.132 -0.937 . . . . 0.0 113.377 -171.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -104.04 101.16 24.11 Favored Pre-proline 0 N--CA 1.473 0.702 0 N-CA-C 105.342 -2.096 . . . . 0.0 105.342 -173.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.01 -77.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.075 2.517 . . . . 0.0 113.344 -169.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -159.54 160.09 34.12 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 127.146 2.178 . . . . 0.0 105.696 174.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 m 60.47 1.4 0.39 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.587 1.555 . . . . 0.0 112.99 -177.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.26 -7.63 55.32 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 127.543 2.337 . . . . 0.0 112.766 -169.543 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.5 mt -120.42 129.41 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.935 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -169.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.7 p -147.67 146.88 29.47 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.495 0.664 . . . . 0.0 112.093 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 93.7 t -127.47 136.52 60.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 171.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.0 mt -139.56 150.73 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 125.981 1.713 . . . . 0.0 106.906 -169.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 55.3 t60 -75.3 -48.78 21.6 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.838 -0.539 . . . . 0.0 109.718 172.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.1 p -157.27 150.15 23.45 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 178.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.68 156.04 26.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 170.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -59.59 -31.21 69.26 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.161 175.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -166.37 173.7 9.75 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 126.844 2.057 . . . . 0.0 107.704 177.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 1.2 p90 -64.12 -33.44 75.77 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 123.747 0.819 . . . . 0.0 111.501 169.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.423 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.5 mt-30 -59.23 -48.83 80.16 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 169.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.34 -30.89 71.78 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 122.048 -0.408 . . . . 0.0 111.438 -179.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.96 -36.8 83.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.529 -0.732 . . . . 0.0 110.026 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.32 -45.64 92.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 169.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -56.65 -45.92 81.35 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.766 0.427 . . . . 0.0 110.296 -177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -67.14 -31.04 71.21 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.872 1.269 . . . . 0.0 112.172 174.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.1 m -64.61 -21.81 66.81 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.875 1.216 . . . . 0.0 111.979 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.6 mmt -123.36 -20.48 5.61 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -169.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -60.99 -34.18 58.78 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-N 121.03 1.741 . . . . 0.0 111.595 -171.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.0 m -62.35 -26.44 68.45 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.778 0.717 . . . . 0.0 111.755 178.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.0 mt -84.83 -40.97 16.52 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.105 0.962 . . . . 0.0 109.179 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.3 tp -56.4 -40.92 75.44 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.775 0.83 . . . . 0.0 110.828 178.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -66.62 -25.44 66.6 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 125.827 1.651 . . . . 0.0 113.788 -171.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -110.82 23.62 13.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.768 0.427 . . . . 0.0 110.019 172.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.305 3.7 p30 45.39 43.06 8.2 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.483 1.513 . . . . 0.0 114.191 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.458 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 41.5 m-85 -71.18 -18.4 62.49 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.329 -0.857 . . . . 0.0 109.076 168.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 pt -145.8 170.77 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.323 2.249 . . . . 0.0 108.734 -178.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.4 m -107.44 161.19 15.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.052 1.741 . . . . 0.0 108.071 169.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -61.32 -30.94 70.81 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.066 -1.021 . . . . 0.0 112.349 -174.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -57.15 -36.2 70.45 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.686 -0.634 . . . . 0.0 111.823 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -58.07 -45.16 87.56 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 123.834 0.854 . . . . 0.0 110.319 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.7 mt -61.83 -50.7 79.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 124.771 1.228 . . . . 0.0 108.486 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -68.29 -26.57 65.71 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 118.089 -0.958 . . . . 0.0 111.924 -174.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.77 -44.91 86.52 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.491 1.041 . . . . 0.0 110.477 173.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.6 mt -69.28 -48.55 67.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 86.7 mttt -58.75 -47.68 83.81 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -175.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.79 -44.04 94.55 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 123.996 0.918 . . . . 0.0 111.012 -176.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -61.22 -44.06 97.88 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 122.743 0.417 . . . . 0.0 110.129 176.011 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.1 m -61.09 -42.59 98.78 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.07 0.948 . . . . 0.0 111.164 178.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 73.5 mt -65.27 -42.32 93.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-N 118.783 0.72 . . . . 0.0 109.481 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -70.13 -38.44 75.53 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -171.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -144.97 12.84 1.44 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 80.87 168.42 39.38 Favored Glycine 0 CA--C 1.533 1.218 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -172.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -65.36 157.76 56.19 Favored 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 123.164 2.576 . . . . 0.0 112.22 -172.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -112.39 -11.24 13.69 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.081 0.952 . . . . 0.0 112.571 -170.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -136.54 77.95 1.68 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.242 1.017 . . . . 0.0 108.5 -169.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.6 mm -124.14 141.5 44.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 mp -130.38 -28.39 2.1 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -169.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.13 161.03 26.54 Favored Pre-proline 0 C--O 1.237 0.396 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -56.72 114.52 1.95 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.017 1.811 . . . . 0.0 109.238 172.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.14 -4.87 57.41 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-O 117.792 -1.56 . . . . 0.0 114.2 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.1 t -129.22 128.53 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.93 1.865 . . . . 0.0 110.212 -169.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -131.67 167.39 19.54 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.292 1.837 . . . . 0.0 109.938 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.448 ' CE ' HD11 ' A' ' 118' ' ' LEU . 8.8 ttm -139.94 57.12 8.87 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.006 0.922 . . . . 0.0 112.151 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -45.81 138.08 11.97 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 121.863 1.709 . . . . 0.0 114.175 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 178.44 154.88 0.39 Allowed 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 129.121 2.968 . . . . 0.0 105.67 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -133.72 161.43 34.71 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 170.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -56.64 149.36 41.54 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-O 118.687 -0.673 . . . . 0.0 109.351 178.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -47.72 -41.01 31.54 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 123.131 2.554 . . . . 0.0 112.767 -177.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -62.74 -15.44 53.12 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.352 1.461 . . . . 0.0 113.285 -177.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 84.7 m -79.8 -2.01 41.4 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.86 0.864 . . . . 0.0 111.705 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.99 20.07 1.51 Allowed Glycine 0 CA--C 1.523 0.548 0 CA-C-O 118.493 -1.171 . . . . 0.0 112.941 174.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.39 148.91 48.97 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 119.415 1.607 . . . . 0.0 108.665 169.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.7 mt -129.53 -33.69 1.85 Allowed 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.259 1.024 . . . . 0.0 110.529 -176.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.458 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 73.7 mttt -145.67 153.85 41.46 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 125.281 1.432 . . . . 0.0 107.694 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.7 m -84.8 126.55 33.53 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 122.854 0.462 . . . . 0.0 109.985 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.95 179.67 42.13 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.665 1.126 . . . . 0.0 110.385 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 60.3 mtp -147.82 168.47 22.1 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.298 1.039 . . . . 0.0 112.767 -173.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -138.65 164.14 30.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.251 1.821 . . . . 0.0 109.441 174.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.458 HD22 HD11 ' A' ' 144' ' ' ILE . 31.3 tp -146.77 100.93 3.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.135 2.174 . . . . 0.0 108.837 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.497 ' O ' HD22 ' A' ' 99' ' ' LEU . 92.2 m -117.27 135.19 54.0 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.316 1.046 . . . . 0.0 109.407 -172.689 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.4 tp -124.99 139.22 54.01 Favored 'General case' 0 CA--C 1.526 0.036 0 C-N-CA 123.795 0.838 . . . . 0.0 108.833 174.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mp -118.3 126.41 52.07 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 126.519 1.928 . . . . 0.0 105.828 175.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -72.23 -35.23 68.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 119.039 0.836 . . . . 0.0 112.31 -178.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 52.1 mm-40 -81.07 -20.08 42.33 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.633 0.773 . . . . 0.0 111.241 172.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 65.2 -174.5 16.5 Favored Glycine 0 CA--C 1.532 1.142 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 -168.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -146.7 165.38 7.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 105.779 -1.934 . . . . 0.0 105.779 168.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -126.75 94.3 4.01 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -169.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -47.17 146.28 3.11 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 124.478 1.111 . . . . 0.0 110.948 174.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.5 -5.25 8.13 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.58 3.52 . . . . 0.0 117.858 -168.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.39 23.03 0.85 Allowed Glycine 0 CA--C 1.524 0.625 0 CA-C-N 120.119 1.327 . . . . 0.0 113.245 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -85.19 171.66 11.8 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 118.671 1.236 . . . . 0.0 111.792 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -67.33 -42.69 83.16 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.884 0.473 . . . . 0.0 111.771 174.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -156.56 170.1 9.45 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 124.848 1.259 . . . . 0.0 111.652 -176.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -62.99 158.05 45.51 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.633 2.222 . . . . 0.0 112.558 177.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 40.5 mm -116.82 132.4 66.64 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 106.97 -1.493 . . . . 0.0 106.97 178.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -98.63 -35.48 10.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 117.658 -1.163 . . . . 0.0 109.55 169.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.497 HD22 ' O ' ' A' ' 82' ' ' THR . 3.2 tm? -115.51 129.96 56.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 119.804 1.184 . . . . 0.0 110.512 -169.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mp -131.38 104.74 7.18 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.513 ' HB ' HD11 ' A' ' 122' ' ' LEU . 0.5 OUTLIER -80.27 138.96 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 168.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -99.42 148.88 18.81 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 108.312 -1.915 . . . . 0.0 108.312 169.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.75 137.55 25.21 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.001 -1.851 . . . . 0.0 106.001 169.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 92.6 p -132.07 147.44 52.44 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 126.305 1.842 . . . . 0.0 106.188 168.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -148.0 133.6 18.79 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -178.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.15 -18.53 59.08 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.239 -0.41 . . . . 0.0 111.781 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -144.25 153.38 41.98 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.852 0.861 . . . . 0.0 110.079 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.17 -35.23 74.88 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.48 -31.12 62.1 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 120.933 -1.104 . . . . 0.0 111.086 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.9 m -64.63 -39.2 93.29 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.845 -0.534 . . . . 0.0 110.261 170.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -58.55 -49.97 75.48 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 123.508 0.723 . . . . 0.0 109.798 171.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 16.4 mm -55.29 -52.13 48.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.94 -41.0 99.19 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 118.971 0.805 . . . . 0.0 111.761 -176.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.27 -46.61 73.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.483 0.713 . . . . 0.0 110.725 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.2 mm -57.72 -46.71 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 124.853 1.261 . . . . 0.0 108.632 176.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -68.21 -14.91 63.34 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.299 -0.876 . . . . 0.0 111.512 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -90.15 -47.38 7.84 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 123.895 0.878 . . . . 0.0 109.539 174.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.448 HD11 ' CE ' ' A' ' 65' ' ' MET . 4.3 pp -70.58 -25.83 63.25 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 121.75 -0.594 . . . . 0.0 111.51 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.0 m -60.77 -21.99 63.61 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 172.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.72 -17.13 64.7 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.35 0.977 . . . . 0.0 110.268 173.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 44.9 mt -105.71 -61.85 1.44 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.26 1.424 . . . . 0.0 109.883 177.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.513 HD11 ' HB ' ' A' ' 101' ' ' ILE . 16.6 mt -68.97 -12.73 61.93 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -173.213 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.3 m -118.38 29.04 7.99 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.993 0.815 . . . . 0.0 110.4 177.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -131.86 99.71 4.84 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.577 1.151 . . . . 0.0 108.052 175.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -57.47 -25.6 59.96 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.038 -0.983 . . . . 0.0 112.488 -176.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -62.68 -48.98 76.91 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.139 0.576 . . . . 0.0 109.822 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.64 -41.26 85.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 123.9 0.88 . . . . 0.0 108.814 178.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 122' ' ' LEU . 34.5 mt -53.91 -43.44 69.73 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 118.64 0.655 . . . . 0.0 111.605 -172.144 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -69.87 -32.31 70.6 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.449 0.568 . . . . 0.0 110.234 -178.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -71.18 -36.68 72.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -178.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 48.6 mt -62.24 -55.57 27.13 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 169.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 58.2 mt -62.42 -9.43 8.35 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -172.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 67.9 p -121.78 4.83 10.0 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.342 1.457 . . . . 0.0 111.546 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.53 113.01 2.21 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.054 0.942 . . . . 0.0 110.527 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.1 m -75.16 -22.49 58.07 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.632 0.773 . . . . 0.0 111.942 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.2 m -147.13 155.49 42.19 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.867 0.867 . . . . 0.0 109.895 -169.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -62.18 -31.93 72.49 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 123.775 0.83 . . . . 0.0 110.506 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -57.61 -36.5 71.85 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 123.06 0.544 . . . . 0.0 111.756 173.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -68.15 -38.07 81.74 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.75 0.82 . . . . 0.0 111.438 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 59.4 mt -68.46 -46.56 69.44 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -56.97 -35.2 68.87 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.277 1.031 . . . . 0.0 112.83 173.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -63.22 -45.18 92.82 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 119.36 0.982 . . . . 0.0 110.064 176.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 83.6 mt -62.73 -37.62 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 C-N-CA 123.955 0.902 . . . . 0.0 109.936 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ILE . . . . . 0.458 HD11 HD22 ' A' ' 81' ' ' LEU . 25.0 mm -60.39 -49.01 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 118.412 0.551 . . . . 0.0 110.409 170.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 44.2 m -66.16 -24.96 66.74 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -168.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -65.31 -33.52 76.17 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.85 0.75 . . . . 0.0 111.118 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.132 0 CA-C-O 117.52 -1.711 . . . . 0.0 109.197 -169.398 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.0 ttm . . . . . 0 N--CA 1.487 1.396 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -64.17 114.27 4.09 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -54.35 -43.73 71.55 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.141 1.376 . . . . 0.0 109.457 -178.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.8 -18.43 8.52 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.246 1.418 . . . . 0.0 113.183 -177.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -66.99 -31.12 71.46 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.449 1.022 . . . . 0.0 111.648 176.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -87.86 -30.65 20.0 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.508 -0.758 . . . . 0.0 112.346 -173.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -91.13 109.81 37.97 Favored Pre-proline 0 CA--C 1.543 0.706 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -176.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.3 -83.55 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.835 2.357 . . . . 0.0 112.625 -169.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -157.39 163.21 38.82 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 127.257 2.223 . . . . 0.0 106.113 172.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 57.58 5.06 0.28 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.771 1.628 . . . . 0.0 113.125 -175.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.4 p -81.98 1.28 36.21 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.734 2.814 . . . . 0.0 113.393 -168.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.4 mt -131.61 123.26 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -169.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.0 m -142.6 146.42 34.54 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 123.413 0.446 . . . . 0.0 111.488 -176.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -118.81 141.25 39.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 105.496 -2.039 . . . . 0.0 105.496 169.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.3 mt -140.69 148.23 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 C-N-CA 125.714 1.606 . . . . 0.0 107.441 -169.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -69.37 -52.62 25.36 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 172.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 t -162.03 163.56 28.72 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 169.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.93 158.45 21.57 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.92 -0.771 . . . . 0.0 108.92 173.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -59.07 -43.43 91.75 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.419 174.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -164.53 177.41 8.14 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 128.031 2.532 . . . . 0.0 107.555 173.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -55.52 -37.88 68.49 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.028 1.731 . . . . 0.0 113.819 176.033 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.409 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.9 mt-30 -62.64 -49.71 74.09 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 120.158 1.345 . . . . 0.0 108.489 173.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -60.41 -33.28 72.28 Favored 'General case' 0 C--O 1.223 -0.314 0 O-C-N 121.906 -0.496 . . . . 0.0 111.707 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.32 -37.3 86.67 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.645 -0.66 . . . . 0.0 110.637 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.97 -47.14 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 170.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -58.87 -48.97 79.51 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 123.266 0.626 . . . . 0.0 110.374 -174.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -60.81 -31.32 70.72 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.508 1.123 . . . . 0.0 111.4 173.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.9 m -82.66 -9.02 59.56 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 119.566 1.075 . . . . 0.0 113.676 179.214 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 14.2 mmt -121.26 -20.93 6.54 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.12 0.873 . . . . 0.0 112.821 -176.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.8 p -57.47 -34.03 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 120.352 1.433 . . . . 0.0 111.982 -173.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.0 m -65.07 -29.43 70.31 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.211 0.914 . . . . 0.0 111.902 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.2 mt -79.5 -42.47 25.15 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.092 0.957 . . . . 0.0 108.737 173.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.6 -44.01 85.11 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.921 0.888 . . . . 0.0 110.763 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.6 -28.76 67.46 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 126.651 1.98 . . . . 0.0 113.136 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -111.4 21.06 16.65 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.292 0.7 OUTLIER 47.99 33.44 3.44 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.132 1.773 . . . . 0.0 114.67 -178.953 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -67.86 -22.18 65.13 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.865 -1.147 . . . . 0.0 111.318 169.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.1 pt -145.37 172.59 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 C-N-CA 126.26 1.824 . . . . 0.0 108.235 -174.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 m -108.98 161.04 15.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.618 1.567 . . . . 0.0 108.366 172.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.57 -32.54 72.64 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.863 -1.148 . . . . 0.0 111.464 -178.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -59.01 -36.31 74.71 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.771 -0.581 . . . . 0.0 111.877 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -58.73 -48.24 81.84 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 123.386 0.674 . . . . 0.0 109.487 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 28.8 mt -57.97 -49.91 79.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 124.336 1.054 . . . . 0.0 108.923 178.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -68.19 -26.96 66.0 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.06 -0.971 . . . . 0.0 111.831 -175.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.24 -40.1 89.06 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.812 1.187 . . . . 0.0 110.815 172.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.7 mt -67.97 -51.91 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.409 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.0 mttt -58.9 -43.84 91.08 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -175.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -63.76 -45.76 88.35 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.465 1.106 . . . . 0.0 111.124 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 27.7 m -63.22 -38.2 90.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.402 0.546 . . . . 0.0 110.794 177.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 88.0 m -60.81 -48.46 81.68 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.136 0.974 . . . . 0.0 109.578 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.11 -42.07 93.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 C-N-CA 123.261 0.624 . . . . 0.0 110.195 178.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -70.55 -36.8 73.87 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -171.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -144.77 -45.6 0.24 Allowed 'General case' 0 C--O 1.231 0.12 0 C-N-CA 122.933 0.493 . . . . 0.0 111.691 -168.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 154.12 164.82 13.13 Favored Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 177.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -58.21 144.37 95.63 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.36 2.707 . . . . 0.0 111.275 -177.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.08 -40.72 64.26 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.827 1.251 . . . . 0.0 113.656 -170.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -150.76 140.58 21.83 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.7 mm -131.22 134.33 61.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 102.179 -3.267 . . . . 0.0 102.179 172.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -116.92 -28.92 6.15 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -168.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -165.73 163.67 12.42 Favored Pre-proline 0 C--O 1.237 0.437 0 C-N-CA 125.311 1.444 . . . . 0.0 107.536 -177.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -46.52 116.88 1.76 Allowed 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 123.027 2.485 . . . . 0.0 110.993 169.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.8 0.93 83.28 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.47 -1.739 . . . . 0.0 114.888 175.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.2 t -127.83 126.59 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 120.232 2.016 . . . . 0.0 109.605 -170.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.15 164.58 22.17 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 125.595 1.558 . . . . 0.0 110.06 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 tmm? -149.05 76.95 9.35 Favored Pre-proline 0 C--O 1.223 -0.313 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -59.04 -89.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 122.849 2.366 . . . . 0.0 114.985 -169.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . 0.254 0.0 OUTLIER 51.26 177.15 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.025 2.13 . . . . 0.0 113.943 -169.176 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.53 159.88 40.21 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 125.307 1.443 . . . . 0.0 108.568 177.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -62.53 147.78 91.75 Favored Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.09 177.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -44.58 -44.42 13.76 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 124.479 3.452 . . . . 0.0 114.032 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.42 -12.04 12.86 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.286 1.435 . . . . 0.0 113.843 -176.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 60.0 m -79.28 -4.15 49.38 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.615 0.643 . . . . 0.0 111.62 179.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 127.36 19.2 1.93 Allowed Glycine 0 C--N 1.337 0.622 0 CA-C-O 118.539 -1.145 . . . . 0.0 113.249 175.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.49 149.32 50.23 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 119.206 1.503 . . . . 0.0 109.075 169.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -130.78 -31.52 1.74 Allowed 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.375 1.07 . . . . 0.0 110.661 -174.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -146.18 157.35 43.82 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.011 1.324 . . . . 0.0 108.951 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.427 ' HA ' ' O ' ' A' ' 104' ' ' SER . 89.7 m -90.31 126.15 35.76 Favored 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 123.041 0.536 . . . . 0.0 110.203 -177.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -168.98 -174.52 37.62 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 125.482 1.515 . . . . 0.0 111.252 -175.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 40.8 mtt -151.42 170.06 20.5 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.103 1.761 . . . . 0.0 111.064 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 36.6 m -153.41 169.65 22.63 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.56 1.544 . . . . 0.0 109.931 171.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 18.1 tp -142.91 130.18 20.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 127.145 2.178 . . . . 0.0 109.561 -169.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.475 ' O ' HD22 ' A' ' 99' ' ' LEU . 35.7 m -136.52 133.86 36.93 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -176.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 17.3 tp -125.38 134.51 52.14 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 171.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.5 mp -110.63 133.52 53.25 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 173.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -67.6 -43.87 79.46 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 118.308 0.504 . . . . 0.0 110.676 176.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -84.54 -24.73 29.17 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.806 0.842 . . . . 0.0 112.271 -177.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 71.69 165.54 7.27 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -168.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -135.2 163.47 35.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 169.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -120.55 93.36 4.02 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.867 0.841 . . . . 0.0 111.422 -168.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -49.89 140.09 16.13 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 114.66 -1.154 . . . . 0.0 112.221 171.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -65.25 159.25 48.06 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.36 2.04 . . . . 0.0 109.835 169.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.18 -35.14 1.5 Allowed Glycine 0 CA--C 1.534 1.232 0 C-N-CA 124.373 0.987 . . . . 0.0 113.039 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.427 HD21 HD11 ' A' ' 97' ' ' ILE . 40.7 t-20 -68.79 177.87 2.37 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.079 1.352 . . . . 0.0 110.25 169.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -114.0 -20.09 11.16 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.295 1.038 . . . . 0.0 113.256 -174.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -149.66 163.26 25.6 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -58.16 152.87 49.51 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.31 2.673 . . . . 0.0 112.93 176.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.427 HD11 HD21 ' A' ' 93' ' ' ASN . 38.6 mm -115.81 128.23 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 174.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -94.43 -34.01 12.9 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.458 -1.258 . . . . 0.0 109.858 169.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.475 HD22 ' O ' ' A' ' 82' ' ' THR . 3.1 tm? -119.51 131.15 55.5 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 120.333 1.424 . . . . 0.0 110.17 -169.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mp -129.37 135.4 48.67 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -111.32 132.16 60.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 168.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -103.38 157.46 17.66 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.478 HD23 ' N ' ' A' ' 104' ' ' SER . 0.7 OUTLIER -146.95 154.59 41.44 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 -179.827 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.478 ' N ' HD23 ' A' ' 103' ' ' LEU . 88.3 p -142.85 146.15 33.85 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 104.63 -2.359 . . . . 0.0 104.63 168.324 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.23 129.43 12.77 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 119.535 1.061 . . . . 0.0 108.987 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -74.57 -18.92 60.5 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.819 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -141.86 151.97 43.2 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 123.715 0.806 . . . . 0.0 110.328 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.65 -33.66 73.13 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -175.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -78.21 -31.06 49.21 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 119.313 0.96 . . . . 0.0 111.061 177.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.0 m -62.81 -39.4 94.18 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 169.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.91 -48.34 80.17 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.387 1.075 . . . . 0.0 110.483 171.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.5 mm -58.71 -51.89 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.49 -38.8 95.43 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 118.912 0.778 . . . . 0.0 111.651 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.8 -53.5 39.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.306 1.042 . . . . 0.0 110.394 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.4 mm -51.17 -48.16 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.663 1.585 . . . . 0.0 108.56 176.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -68.27 -16.09 63.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.425 0.69 . . . . 0.0 112.006 -176.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -87.5 -44.83 11.0 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.631 0.773 . . . . 0.0 109.613 172.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.403 HD21 HD12 ' A' ' 103' ' ' LEU . 3.8 pp -68.78 -25.77 64.87 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 118.662 0.664 . . . . 0.0 111.316 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 49.1 m -60.79 -21.88 63.53 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 123.759 0.823 . . . . 0.0 112.32 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -66.5 -17.68 64.94 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.307 0.958 . . . . 0.0 110.299 173.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 36.1 mt -105.95 -58.69 1.88 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.382 1.473 . . . . 0.0 109.898 177.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.8 -28.13 65.7 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 114.433 1.272 . . . . 0.0 114.433 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 42.0 m -108.52 26.73 10.15 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.912 0.778 . . . . 0.0 110.844 -175.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -132.42 97.51 4.12 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 124.679 1.192 . . . . 0.0 108.054 178.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.54 -27.46 49.06 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.841 0.856 . . . . 0.0 112.526 -177.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.13 -44.83 87.42 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.104 0.562 . . . . 0.0 110.013 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.62 -44.98 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 174.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.8 mt -53.74 -45.73 70.62 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 118.429 0.559 . . . . 0.0 111.555 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -65.78 -38.55 89.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.435 0.561 . . . . 0.0 110.705 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.401 ' HB3' HD11 ' A' ' 143' ' ' ILE . 45.1 mt-30 -70.1 -32.45 70.51 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 118.64 0.654 . . . . 0.0 110.11 -177.058 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 25.6 mt -68.75 -52.97 24.82 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 55.1 mt -59.17 -13.12 6.37 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -176.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 81.4 p -123.84 10.87 8.97 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.223 1.409 . . . . 0.0 110.898 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.01 119.02 5.58 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 124.624 1.17 . . . . 0.0 109.879 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.5 p -71.95 -16.17 62.09 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.321 1.048 . . . . 0.0 112.307 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 73.4 p -159.38 164.87 34.31 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.571 0.623 . . . . 0.0 111.067 -172.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.27 -33.81 75.35 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 169.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -60.36 -37.47 80.8 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 121.827 -0.545 . . . . 0.0 111.573 174.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -77.28 -28.54 53.43 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 119.703 1.138 . . . . 0.0 110.713 179.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 35.2 mt -65.44 -48.63 72.09 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 120.286 1.403 . . . . 0.0 108.289 169.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.04 -34.1 69.71 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.821 1.248 . . . . 0.0 113.189 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -63.17 -42.01 99.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 119.066 0.848 . . . . 0.0 110.487 176.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.401 HD11 ' HB3' ' A' ' 130' ' ' GLN . 91.4 mt -68.47 -36.54 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 123.343 0.657 . . . . 0.0 109.527 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.3 mm -57.85 -52.64 55.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 169.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 28.8 m -64.11 -28.02 69.49 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 122.816 0.446 . . . . 0.0 111.484 -170.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -59.64 -28.5 67.28 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.675 1.59 . . . . 0.0 113.396 175.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.911 0 N-CA-C 108.904 -1.679 . . . . 0.0 108.904 -174.452 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 tpt . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -65.98 110.0 2.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 168.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.51 -45.99 66.46 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.683 0.793 . . . . 0.0 109.746 -175.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.47 -19.93 6.66 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.279 1.832 . . . . 0.0 113.143 -176.382 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.4 -31.47 72.15 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 119.349 0.977 . . . . 0.0 111.995 175.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -88.3 -22.38 23.92 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.686 -174.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -99.4 100.14 9.9 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 -173.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.18 -81.13 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 123.689 2.926 . . . . 0.0 113.298 -169.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -157.05 161.03 39.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.43 2.292 . . . . 0.0 105.485 172.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 m 59.06 -0.12 0.15 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.568 1.547 . . . . 0.0 113.075 -174.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.1 p -80.05 4.65 16.43 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 128.397 2.679 . . . . 0.0 112.708 -169.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 6.6 mt -133.32 132.04 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 N-CA-C 104.145 -2.539 . . . . 0.0 104.145 -173.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.0 m -156.15 147.4 22.44 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 118.685 0.675 . . . . 0.0 111.066 -179.076 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 85.3 t -116.67 143.45 26.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 169.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mt -138.7 147.51 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 C-N-CA 126.245 1.818 . . . . 0.0 106.31 -172.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -72.47 -47.51 48.18 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.594 -0.691 . . . . 0.0 109.713 172.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.2 p -160.67 141.91 12.0 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.073 -1.455 . . . . 0.0 107.073 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.82 155.1 35.71 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -56.34 -44.83 80.42 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.631 0.772 . . . . 0.0 109.716 177.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -163.58 -176.92 4.93 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.824 2.05 . . . . 0.0 108.242 170.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -64.3 -32.79 74.52 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.485 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 35.0 mt-30 -58.88 -50.52 73.69 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.805 1.639 . . . . 0.0 107.206 171.188 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -60.73 -35.22 75.8 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 121.795 -0.566 . . . . 0.0 111.806 177.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.97 -31.94 72.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 121.894 -0.504 . . . . 0.0 110.905 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.25 -48.53 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 170.06 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -55.96 -45.63 78.84 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 118.23 0.468 . . . . 0.0 110.442 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -64.69 -28.91 69.92 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 118.031 -0.985 . . . . 0.0 112.343 174.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.9 m -69.9 -19.95 63.39 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.223 1.374 . . . . 0.0 112.224 172.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.2 mmt -123.86 -18.68 5.93 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -168.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.2 p -57.03 -37.88 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 120.273 1.397 . . . . 0.0 112.591 -169.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.3 m -67.21 -27.7 67.46 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.825 0.738 . . . . 0.0 111.568 -178.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.4 mt -77.43 -44.37 29.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.649 0.78 . . . . 0.0 108.986 172.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -56.4 -51.02 69.91 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.109 0.964 . . . . 0.0 110.092 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -56.21 -28.59 58.85 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 126.576 1.95 . . . . 0.0 113.757 -176.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -113.71 24.45 12.12 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 123.057 0.543 . . . . 0.0 109.996 -175.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 61.66 20.69 11.54 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 171.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -71.24 -24.18 62.14 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.894 -1.129 . . . . 0.0 111.158 174.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.4 pt -143.88 176.3 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.101 1.76 . . . . 0.0 108.929 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m -114.26 160.56 18.9 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.597 1.959 . . . . 0.0 108.203 175.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -59.02 -37.47 76.98 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.907 1.231 . . . . 0.0 111.826 -175.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -60.71 -22.54 64.07 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.797 0.839 . . . . 0.0 113.206 175.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -65.25 -45.58 83.98 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.798 1.181 . . . . 0.0 109.934 174.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.99 -50.53 79.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -69.86 -23.86 63.34 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.952 -173.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.01 -42.7 90.74 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 120.149 1.341 . . . . 0.0 111.025 172.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.5 mt -70.09 -46.3 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.5 mttt -61.64 -40.62 95.55 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -65.13 -38.55 91.01 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 124.176 0.99 . . . . 0.0 111.445 178.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.9 m -61.72 -42.05 98.43 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.733 -0.604 . . . . 0.0 109.603 171.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 22.6 m -63.33 -35.36 80.11 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.463 -0.773 . . . . 0.0 110.915 177.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 84.6 mt -65.94 -42.39 91.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 119.262 0.937 . . . . 0.0 110.074 172.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -63.64 -34.52 78.02 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.527 0.731 . . . . 0.0 112.545 -169.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -149.83 -44.94 0.13 Allowed 'General case' 0 C--O 1.231 0.121 0 C-N-CA 122.998 0.519 . . . . 0.0 111.918 -169.126 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.23 -179.72 20.52 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 107.887 -2.085 . . . . 0.0 107.887 -169.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.98 136.77 67.71 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 121.975 1.783 . . . . 0.0 110.362 -179.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -100.34 -6.67 25.47 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.967 0.907 . . . . 0.0 112.001 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -129.01 78.0 1.83 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 -169.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.6 mm -124.91 136.02 62.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -121.97 -31.26 3.94 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 123.651 0.78 . . . . 0.0 110.923 -172.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.77 160.21 30.16 Favored Pre-proline 0 CA--C 1.534 0.351 0 C-N-CA 125.883 1.673 . . . . 0.0 106.708 173.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -49.84 119.91 5.36 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.394 2.063 . . . . 0.0 109.979 169.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.9 -6.2 73.07 Favored Glycine 0 CA--C 1.532 1.104 0 CA-C-O 117.843 -1.532 . . . . 0.0 114.465 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.6 t -126.25 117.35 48.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 119.769 1.785 . . . . 0.0 108.339 -170.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -118.76 168.8 10.4 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.412 1.085 . . . . 0.0 110.246 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.528 ' CE ' HD11 ' A' ' 118' ' ' LEU . 7.2 ttm -140.69 62.31 17.72 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 122.93 0.492 . . . . 0.0 111.99 177.003 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.59 135.64 48.54 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 121.56 1.506 . . . . 0.0 111.83 -179.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 176.42 157.61 0.27 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 128.28 2.632 . . . . 0.0 106.221 -170.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.13 163.92 30.46 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.207 1.403 . . . . 0.0 108.224 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -58.11 153.91 32.89 Favored Pre-proline 0 N--CA 1.465 0.312 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.104 175.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.3 -39.21 91.56 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 122.13 1.886 . . . . 0.0 110.446 -172.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -61.86 -15.31 41.27 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.704 1.602 . . . . 0.0 113.055 -178.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 83.7 m -79.11 -8.61 59.12 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.656 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 139.02 13.5 0.69 Allowed Glycine 0 C--N 1.339 0.736 0 CA-C-O 117.825 -1.542 . . . . 0.0 114.206 173.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.29 147.49 52.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.854 1.827 . . . . 0.0 109.625 173.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.1 mt -130.6 -35.55 1.48 Allowed 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.309 1.043 . . . . 0.0 110.32 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -148.6 158.34 44.06 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.292 1.437 . . . . 0.0 108.542 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 83.4 m -90.29 133.74 34.75 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 122.988 0.515 . . . . 0.0 111.927 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -177.34 -179.14 47.49 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.923 1.249 . . . . 0.0 111.11 -177.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 24.2 mtm -146.65 169.67 18.53 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 126.241 1.816 . . . . 0.0 110.775 -179.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.0 m -151.04 170.61 18.96 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.473 1.509 . . . . 0.0 109.425 171.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.418 HD22 HD11 ' A' ' 144' ' ' ILE . 28.9 tp -145.78 131.02 18.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 127.854 2.461 . . . . 0.0 108.408 -169.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 28.6 m -140.78 137.19 33.18 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -173.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -129.27 141.44 51.11 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 172.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.7 mp -119.61 126.83 52.12 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 126.398 1.879 . . . . 0.0 106.368 176.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.42 -44.73 90.32 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.423 0.556 . . . . 0.0 111.251 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 38.1 mm-40 -85.53 -23.54 27.65 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 124.292 1.037 . . . . 0.0 111.667 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 73.97 176.18 33.75 Favored Glycine 0 CA--C 1.532 1.145 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -168.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.93 160.27 13.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 169.317 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -109.76 101.61 10.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.67 0.748 . . . . 0.0 110.543 -168.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -63.54 141.72 97.9 Favored Pre-proline 0 CA--C 1.541 0.633 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.448 169.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -61.17 129.65 29.36 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.116 2.544 . . . . 0.0 112.029 -169.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 68.27 9.63 58.05 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-O 118.51 -1.161 . . . . 0.0 114.639 172.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -74.69 168.29 20.13 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.581 1.691 . . . . 0.0 111.195 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -61.17 -40.94 95.77 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.969 -0.457 . . . . 0.0 111.946 178.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -158.25 164.95 19.66 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 124.725 1.21 . . . . 0.0 110.915 178.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -48.98 142.9 18.86 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.632 2.888 . . . . 0.0 113.407 169.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 22.9 mm -84.93 136.32 23.01 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.291 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 172.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -111.59 -18.46 12.8 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 117.686 -1.149 . . . . 0.0 110.625 170.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 131' ' ' LEU . 15.3 tp -140.4 135.56 32.21 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 120.001 1.273 . . . . 0.0 109.818 -173.044 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.3 mp -138.6 138.37 37.84 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 -174.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.1 mt -115.24 128.93 72.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 168.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.28 149.95 21.66 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 108.592 -1.803 . . . . 0.0 108.592 170.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 104' ' ' SER . 0.5 OUTLIER -148.6 144.82 27.48 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 172.846 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.541 ' N ' HD23 ' A' ' 103' ' ' LEU . 77.9 p -142.48 145.95 34.25 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 168.299 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.474 ' HB3' ' CG ' ' A' ' 111' ' ' HIS . . . -145.96 145.85 30.81 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 118.553 0.615 . . . . 0.0 109.706 171.19 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.89 -16.94 59.96 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.477 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -137.61 155.8 48.78 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.362 0.665 . . . . 0.0 110.746 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.37 -38.62 90.27 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.342 0.657 . . . . 0.0 112.472 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -73.05 -31.1 64.2 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.211 -0.93 . . . . 0.0 110.837 178.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.3 m -64.36 -37.99 89.44 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.289 169.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.474 ' CG ' ' HB3' ' A' ' 105' ' ' ALA . 24.0 m80 -62.23 -44.64 96.1 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.779 171.134 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.6 -51.28 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-N 119.141 0.882 . . . . 0.0 108.874 177.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.59 -40.72 96.74 Favored Glycine 0 CA--C 1.531 1.063 0 CA-C-N 119.063 0.847 . . . . 0.0 111.916 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.15 70.7 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.617 0.767 . . . . 0.0 111.096 -179.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 5.0 mm -58.91 -46.12 91.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 125.201 1.4 . . . . 0.0 108.168 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.1 mm-40 -69.02 -9.97 55.18 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.135 -0.978 . . . . 0.0 111.623 -178.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.41 -50.63 5.54 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.929 0.892 . . . . 0.0 108.93 172.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.528 HD11 ' CE ' ' A' ' 65' ' ' MET . 3.9 pp -68.52 -27.34 66.02 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.773 -0.579 . . . . 0.0 111.646 -176.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.4 m -62.42 -20.98 65.04 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.318 0.508 . . . . 0.0 112.062 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -64.16 -19.12 65.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.283 0.947 . . . . 0.0 110.096 171.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 33.4 mt -108.12 -60.54 1.71 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.022 1.729 . . . . 0.0 110.941 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.4 mt -65.75 -18.13 65.11 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -175.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.6 m -111.39 26.84 10.25 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.268 0.94 . . . . 0.0 110.887 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -139.54 97.47 3.28 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -172.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -55.83 -27.39 51.24 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.789 0.836 . . . . 0.0 112.418 -175.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -61.95 -45.08 95.22 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 122.875 0.47 . . . . 0.0 110.125 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.5 mp -71.69 -45.04 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 123.662 0.785 . . . . 0.0 108.887 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.0 mt -55.69 -41.67 74.06 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.026 -172.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -70.83 -33.98 71.22 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 118.435 0.561 . . . . 0.0 110.327 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -66.13 -41.65 90.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.222 0.919 . . . . 0.0 108.764 179.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.465 HD13 HD21 ' A' ' 99' ' ' LEU . 21.4 mt -69.02 -48.08 63.86 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 64.1 mt -62.66 -5.9 3.1 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 178.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 73.8 p -122.6 11.73 9.89 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.346 1.458 . . . . 0.0 110.923 175.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.17 110.09 2.07 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 124.378 1.071 . . . . 0.0 109.974 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -73.99 -14.71 61.07 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.782 0.833 . . . . 0.0 112.303 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 82.1 p -151.73 163.74 38.48 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 118.943 0.792 . . . . 0.0 110.866 -174.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.74 -39.67 74.4 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.523 1.129 . . . . 0.0 109.671 169.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -59.93 -40.01 87.47 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 123.27 0.628 . . . . 0.0 110.84 177.83 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -65.85 -38.76 89.73 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 118.865 0.757 . . . . 0.0 112.261 177.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.3 mt -62.79 -48.24 79.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.637 1.108 . . . . 0.0 108.517 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.74 -37.19 73.17 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.561 1.145 . . . . 0.0 113.66 174.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.83 -39.72 95.21 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 121.187 -0.946 . . . . 0.0 110.099 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 49.9 mt -71.93 -35.76 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 123.718 0.807 . . . . 0.0 110.206 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ILE . . . . . 0.418 HD11 HD22 ' A' ' 81' ' ' LEU . 17.1 mm -57.01 -46.28 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 118.835 0.743 . . . . 0.0 109.776 169.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 43.8 m -65.02 -22.53 67.01 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -169.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.482 ' HG2' HH11 ' A' ' 146' ' ' ARG . 6.1 mtt-85 -68.11 -35.72 78.59 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.978 0.808 . . . . 0.0 111.509 176.595 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.154 0 CA-C-O 117.779 -1.567 . . . . 0.0 110.834 -168.764 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.759 0.314 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -65.44 115.18 5.42 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -53.67 -45.33 70.25 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.466 1.104 . . . . 0.0 108.457 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.42 -27.1 5.83 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 126.519 1.928 . . . . 0.0 113.34 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.52 -28.38 68.36 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.947 0.794 . . . . 0.0 112.539 178.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -93.09 -14.68 26.97 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.03 0.932 . . . . 0.0 113.085 -173.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -102.65 114.43 65.33 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 120.561 1.528 . . . . 0.0 108.589 -173.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.82 -76.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.436 2.757 . . . . 0.0 113.46 -176.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.401 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.7 tp10 -162.52 -68.84 0.05 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.432 1.093 . . . . 0.0 110.957 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -67.32 4.53 0.95 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.923 1.289 . . . . 0.0 112.077 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.401 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -70.51 -8.73 53.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.534 1.934 . . . . 0.0 113.056 -170.742 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.9 mt -120.52 125.5 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -169.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.6 m -145.27 149.58 35.11 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.321 0.581 . . . . 0.0 111.219 -175.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.5 t -126.25 138.49 54.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 170.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.1 mt -139.25 150.45 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 -174.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -70.19 -46.69 64.07 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.699 -0.625 . . . . 0.0 110.282 177.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.1 p -164.15 146.66 9.15 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.604 ' HB3' HG21 ' A' ' 88' ' ' VAL . . . -76.89 160.98 28.77 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -57.48 -43.39 84.04 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.07 0.548 . . . . 0.0 110.417 173.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -168.35 178.86 4.69 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 127.038 2.135 . . . . 0.0 108.342 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -61.81 -34.33 75.74 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.807 1.643 . . . . 0.0 113.045 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.436 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 53.9 mm-40 -62.03 -50.93 70.03 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.663 1.574 . . . . 0.0 107.834 169.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -60.25 -35.44 75.5 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 121.836 -0.54 . . . . 0.0 111.705 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.1 -31.89 73.14 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.555 0.742 . . . . 0.0 110.751 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -71.16 -46.71 64.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 173.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -56.93 -45.86 82.45 Favored 'General case' 0 C--O 1.226 -0.18 0 O-C-N 121.656 -0.653 . . . . 0.0 110.517 178.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -64.1 -30.33 71.41 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.375 -0.821 . . . . 0.0 111.894 174.612 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 m -67.45 -27.29 66.91 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.587 1.085 . . . . 0.0 112.173 173.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 2.2 mmm -119.79 -13.54 9.09 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.087 1.312 . . . . 0.0 114.425 -169.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.6 p -58.21 -39.13 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 120.792 1.633 . . . . 0.0 112.723 -169.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.0 m -66.11 -22.78 66.41 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.017 0.826 . . . . 0.0 111.908 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.7 mt -82.55 -43.05 17.58 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.061 0.944 . . . . 0.0 108.925 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.82 -49.96 71.83 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.094 0.958 . . . . 0.0 109.737 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.58 -30.6 61.13 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 126.212 1.805 . . . . 0.0 113.947 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.8 mttm -111.27 22.66 14.94 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.35 -175.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 57.74 25.42 11.83 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.463 -0.79 . . . . 0.0 113.054 173.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -69.12 -25.72 64.54 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.279 -0.888 . . . . 0.0 110.368 169.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.3 pt -144.47 176.54 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 125.759 1.623 . . . . 0.0 109.288 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.5 m -116.61 159.1 22.66 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.7 2.0 . . . . 0.0 108.04 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -58.56 -33.44 69.92 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.651 1.114 . . . . 0.0 113.22 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -57.02 -32.23 65.94 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.169 0.587 . . . . 0.0 111.775 175.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -60.23 -45.77 92.09 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.366 0.666 . . . . 0.0 110.421 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.31 -49.32 83.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -69.6 -24.54 63.68 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.219 -177.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.47 -44.42 94.46 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 120.084 1.311 . . . . 0.0 110.488 174.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 56.1 mt -67.04 -47.04 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.5 mttt -58.67 -43.91 90.05 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 117.89 0.314 . . . . 0.0 110.781 -178.075 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -67.41 -39.87 85.54 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 124.272 1.029 . . . . 0.0 110.934 -178.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.6 m -62.14 -40.59 96.45 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.281 0.562 . . . . 0.0 110.223 173.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.4 m -65.35 -36.63 84.59 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.01 0.924 . . . . 0.0 110.917 177.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 72.3 mt -68.17 -41.86 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 119.135 0.879 . . . . 0.0 109.844 172.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -64.37 -37.28 86.96 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.9 0.88 . . . . 0.0 112.433 -170.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.06 -46.11 0.2 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 123.69 0.796 . . . . 0.0 110.828 -168.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.28 173.78 15.1 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 109.444 -1.463 . . . . 0.0 109.444 -175.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_exo -44.52 126.8 7.21 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 123.99 3.127 . . . . 0.0 112.395 172.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -88.74 -11.44 45.05 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.978 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -135.27 98.0 3.86 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -169.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 23.8 mm -141.19 139.13 33.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 mp -132.09 -25.8 1.98 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -170.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.13 161.43 25.85 Favored Pre-proline 0 C--O 1.237 0.401 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 176.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -49.63 116.38 2.31 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.487 2.125 . . . . 0.0 111.005 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.55 4.92 69.84 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.152 -1.36 . . . . 0.0 114.501 177.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.6 t -129.5 122.69 55.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-N 119.33 1.565 . . . . 0.0 108.81 -169.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -121.09 166.03 14.49 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.297 1.439 . . . . 0.0 110.122 177.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 24.7 ttm -136.41 63.88 50.22 Favored Pre-proline 0 CA--C 1.542 0.663 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.73 173.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.52 147.57 22.68 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.18 1.92 . . . . 0.0 113.865 -173.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 174.07 154.92 0.12 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.535 2.334 . . . . 0.0 107.329 -169.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.66 151.7 50.47 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 106.657 -1.609 . . . . 0.0 106.657 169.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -53.6 141.86 43.62 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-O 117.429 -1.272 . . . . 0.0 109.265 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -43.67 -44.46 11.24 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 124.24 3.293 . . . . 0.0 114.645 -170.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -63.73 -9.23 13.18 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.689 1.196 . . . . 0.0 114.023 -177.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 61.7 m -76.63 -1.66 28.8 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.128 0.971 . . . . 0.0 111.867 175.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 129.09 13.48 2.4 Favored Glycine 0 C--N 1.336 0.577 0 CA-C-O 118.185 -1.341 . . . . 0.0 112.985 172.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.4 148.26 52.02 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 119.342 1.571 . . . . 0.0 109.278 170.006 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 86.2 mt -133.04 -31.05 1.3 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 124.751 1.22 . . . . 0.0 110.975 -173.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -143.91 166.84 23.81 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 126.057 1.743 . . . . 0.0 107.042 178.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.2 m -101.93 125.91 48.71 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 123.17 0.588 . . . . 0.0 109.734 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -174.28 175.76 46.67 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.714 1.149 . . . . 0.0 111.276 -177.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.7 ' SD ' HD21 ' A' ' 118' ' ' LEU . 56.8 mtt -140.72 167.71 21.53 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.803 1.241 . . . . 0.0 112.246 -170.485 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 p -144.25 165.33 28.18 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.136 1.774 . . . . 0.0 109.377 178.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.489 HD22 HD11 ' A' ' 144' ' ' ILE . 34.0 tp -146.92 110.81 5.01 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.191 1.797 . . . . 0.0 107.861 -169.031 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 31.5 m -127.02 139.35 53.08 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -171.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 12.1 tp -135.22 145.35 47.56 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 174.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -125.01 112.35 16.46 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 126.161 1.785 . . . . 0.0 106.193 -173.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -59.83 -24.79 64.47 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -116.79 -5.32 11.56 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.192 0.997 . . . . 0.0 112.088 -177.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.95 168.58 4.43 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.628 1.109 . . . . 0.0 113.49 -173.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.604 HG21 ' HB3' ' A' ' 18' ' ' ALA . 16.3 t -139.11 148.99 23.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 105.137 -2.172 . . . . 0.0 105.137 174.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -116.42 100.62 8.0 Favored 'General case' 0 C--N 1.334 -0.093 0 O-C-N 121.762 -0.586 . . . . 0.0 110.712 -168.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -59.11 150.99 59.41 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.679 173.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -75.62 -0.58 10.32 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.455 2.77 . . . . 0.0 115.119 -172.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -149.05 35.78 1.06 Allowed Glycine 0 CA--C 1.526 0.735 0 CA-C-N 119.659 1.118 . . . . 0.0 113.02 -171.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -131.82 161.11 33.73 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 118.029 0.914 . . . . 0.0 108.559 172.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -72.91 -21.79 60.84 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -171.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -149.51 164.86 19.23 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.105 0.962 . . . . 0.0 111.699 -176.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -74.39 150.26 41.05 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.835 2.356 . . . . 0.0 110.714 177.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 40.7 mm -99.53 136.91 28.71 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 -177.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -109.72 -14.24 14.36 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 117.161 -1.4 . . . . 0.0 111.096 172.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.511 HD21 HD13 ' A' ' 131' ' ' LEU . 37.3 tp -144.11 131.9 21.36 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 120.603 1.547 . . . . 0.0 110.319 -169.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mp -138.71 117.2 12.07 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 -174.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.735 HG21 HD22 ' A' ' 118' ' ' LEU . 1.4 mp -98.39 111.02 27.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 105.141 -2.17 . . . . 0.0 105.141 173.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.07 151.39 36.91 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 174.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.436 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -143.26 142.93 31.53 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 105.408 -2.071 . . . . 0.0 105.408 172.05 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.436 ' N ' HD23 ' A' ' 103' ' ' LEU . 27.4 p -135.68 144.24 45.87 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 127.248 2.219 . . . . 0.0 106.498 169.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.8 135.94 22.57 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -175.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -77.98 -22.41 49.43 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.723 0.409 . . . . 0.0 111.803 -177.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -144.05 155.67 44.08 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.011 0.924 . . . . 0.0 110.019 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.09 -34.99 74.23 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -177.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -75.97 -32.11 59.33 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.865 -1.147 . . . . 0.0 110.937 177.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.9 m -62.51 -41.12 98.61 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 169.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 23.4 t60 -58.27 -49.93 75.4 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.027 0.931 . . . . 0.0 110.038 173.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.6 mm -55.94 -54.19 29.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 118.875 0.761 . . . . 0.0 109.568 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.06 -38.77 94.79 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.669 0.668 . . . . 0.0 111.702 -176.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.56 -48.49 60.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.466 1.107 . . . . 0.0 111.1 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.32 -43.55 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 124.489 1.115 . . . . 0.0 108.758 176.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -70.47 -11.11 60.71 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.716 0.806 . . . . 0.0 111.991 -178.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.88 -45.32 12.37 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 169.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.735 HD22 HG21 ' A' ' 101' ' ' ILE . 95.8 mt -71.13 -30.29 66.31 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.742 -0.599 . . . . 0.0 112.042 -173.668 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.1 m -61.44 -21.1 63.83 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 122.98 0.512 . . . . 0.0 112.076 172.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -68.7 -28.18 66.61 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.608 1.094 . . . . 0.0 110.0 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 40.0 mt -96.66 -63.6 1.12 Allowed 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.0 0.92 . . . . 0.0 111.037 -178.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.41 ' HA ' HD21 ' A' ' 128' ' ' LEU . 17.2 mt -73.38 -1.13 16.9 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -169.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 55.6 m -112.04 27.83 9.3 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.529 1.059 . . . . 0.0 111.357 174.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -141.33 97.66 3.21 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -171.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.87 -26.16 58.15 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.658 0.783 . . . . 0.0 112.371 -173.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -63.43 -46.3 86.95 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.224 0.535 . . . . 0.0 109.79 176.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.54 -43.79 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 C-N-CA 124.427 1.091 . . . . 0.0 109.134 176.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 122' ' ' LEU . 46.8 mt -56.52 -44.58 80.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 118.945 -0.55 . . . . 0.0 110.976 -173.047 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -67.04 -38.54 86.07 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 118.152 0.433 . . . . 0.0 110.367 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.402 ' HB3' HD11 ' A' ' 143' ' ' ILE . 49.2 mt-30 -67.64 -35.86 79.69 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 118.723 0.692 . . . . 0.0 109.696 -177.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.511 HD13 HD21 ' A' ' 99' ' ' LEU . 26.2 mt -70.06 -51.98 27.62 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 173.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 57.4 mt -60.54 -12.03 8.75 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 80.7 p -120.39 8.09 10.75 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.844 1.258 . . . . 0.0 111.321 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.49 114.67 3.08 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.591 1.156 . . . . 0.0 109.782 177.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.8 m -75.5 -20.26 58.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.857 0.863 . . . . 0.0 111.865 178.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.3 m -147.79 157.55 43.59 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.976 0.91 . . . . 0.0 109.939 -169.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -61.01 -38.62 86.72 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.434 1.093 . . . . 0.0 110.522 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -58.61 -36.63 74.32 Favored 'General case' 0 C--O 1.226 -0.178 0 O-C-N 121.946 -0.471 . . . . 0.0 111.389 175.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -68.87 -34.14 74.94 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 123.727 0.811 . . . . 0.0 112.074 177.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LEU . . . . . 0.425 ' HB3' HD21 ' A' ' 81' ' ' LEU . 58.6 mt -67.28 -45.46 76.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.733 1.151 . . . . 0.0 107.954 172.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -64.65 -27.08 68.68 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -61.55 -38.84 88.94 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 120.776 -1.203 . . . . 0.0 109.914 174.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.402 HD11 ' HB3' ' A' ' 130' ' ' GLN . 80.1 mt -72.37 -34.99 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 124.514 1.125 . . . . 0.0 109.221 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ILE . . . . . 0.489 HD11 HD22 ' A' ' 81' ' ' LEU . 36.3 mm -56.45 -51.76 60.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 169.172 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.6 m -65.57 -29.59 70.22 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.987 -170.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -61.51 -30.15 70.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.495 1.918 . . . . 0.0 112.569 172.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.006 0 CA-C-O 117.931 -1.483 . . . . 0.0 110.435 -172.357 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 ttt . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.14 112.78 1.3 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.889 0.376 . . . . 0.0 111.792 171.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.2 -34.38 68.46 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 123.359 0.664 . . . . 0.0 109.876 169.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -59.9 -12.29 7.37 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.189 1.396 . . . . 0.0 113.166 176.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -87.09 -32.22 20.05 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.618 1.099 . . . . 0.0 112.957 171.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -86.35 -43.81 12.58 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 122.794 0.438 . . . . 0.0 110.413 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.425 ' CD1' HG21 ' A' ' 144' ' ' ILE . 0.0 OUTLIER -86.66 119.25 71.2 Favored Pre-proline 0 CA--C 1.551 1.013 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 -178.06 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -82.66 -97.72 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.866 3.044 . . . . 0.0 112.225 -169.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -151.66 163.27 39.48 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.836 2.054 . . . . 0.0 106.756 173.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m 57.37 14.51 2.21 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.7 1.6 . . . . 0.0 112.226 -169.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.2 p -103.27 19.99 18.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.535 2.334 . . . . 0.0 112.354 -168.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.8 mt -133.74 141.35 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 169.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.8 m -156.93 149.45 23.34 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 169.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.7 t -113.48 133.56 59.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 103.793 -2.669 . . . . 0.0 103.793 169.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.2 mt -131.67 147.68 32.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -169.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -67.81 -44.64 76.82 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.814 -0.554 . . . . 0.0 110.604 177.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.7 m -165.47 148.55 7.95 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 -176.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.71 148.56 34.88 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 171.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.34 -37.48 83.47 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.109 0.564 . . . . 0.0 110.703 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -164.05 -179.21 6.06 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 127.078 2.151 . . . . 0.0 106.805 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 39.4 p-90 -66.48 -33.81 76.52 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 121.584 -0.698 . . . . 0.0 111.812 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.468 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 49.2 mt-30 -54.52 -51.08 66.29 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 169.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.37 -31.78 72.77 Favored 'General case' 0 C--O 1.222 -0.382 0 O-C-N 121.842 -0.536 . . . . 0.0 111.411 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.8 87.55 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 121.853 -0.529 . . . . 0.0 109.812 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.4 -45.68 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -57.92 -45.59 86.31 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.981 0.512 . . . . 0.0 110.423 -174.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -66.68 -32.26 73.46 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.778 -1.106 . . . . 0.0 111.815 173.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.3 m -61.42 -24.89 66.84 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 120.023 1.283 . . . . 0.0 111.675 173.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 9.3 mmt -120.13 -19.81 7.62 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -169.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.8 p -61.03 -34.15 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 CA-C-N 121.571 1.987 . . . . 0.0 112.212 -171.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.4 m -64.78 -30.11 71.11 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.245 0.929 . . . . 0.0 111.354 178.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.2 mt -74.57 -44.26 51.74 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.97 0.908 . . . . 0.0 108.584 172.104 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.4 tp -56.76 -40.17 75.34 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.881 0.872 . . . . 0.0 110.96 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -66.64 -30.59 70.89 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.116 1.367 . . . . 0.0 113.049 -173.034 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -98.81 14.71 27.86 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.001 0.364 . . . . 0.0 110.764 172.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.454 0.0 OUTLIER 44.9 43.62 7.22 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.183 2.193 . . . . 0.0 115.357 -169.636 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.478 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 30.6 m-85 -66.44 -19.75 65.88 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.509 -0.745 . . . . 0.0 109.489 168.05 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.1 pt -143.91 171.2 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 127.152 2.181 . . . . 0.0 108.585 -176.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.0 m -103.78 159.22 15.82 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.065 1.746 . . . . 0.0 107.52 169.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -59.87 -32.44 70.71 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.113 -0.992 . . . . 0.0 111.623 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -57.51 -34.96 69.65 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.12 0.568 . . . . 0.0 112.0 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -59.78 -40.84 89.61 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.72 0.808 . . . . 0.0 110.643 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.408 HG22 ' HE3' ' A' ' 47' ' ' LYS . 13.2 mt -63.73 -49.88 80.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.426 1.09 . . . . 0.0 108.599 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.2 mm100 -66.14 -28.5 68.84 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 118.59 -0.719 . . . . 0.0 112.479 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.19 -43.16 78.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 118.82 0.736 . . . . 0.0 110.684 173.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 52.2 mt -69.26 -47.16 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.468 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.6 mttt -62.43 -43.87 97.78 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.373 0.533 . . . . 0.0 111.051 -173.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -66.61 -40.85 89.03 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.237 1.015 . . . . 0.0 110.757 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.443 ' HB3' ' CE1' ' A' ' 56' ' ' TYR . 18.3 m -63.98 -34.5 78.12 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.938 -0.476 . . . . 0.0 110.415 174.208 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 92.3 m -65.13 -39.77 93.51 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.752 0.821 . . . . 0.0 110.805 175.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.9 mt -63.48 -43.96 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 119.35 0.977 . . . . 0.0 109.82 171.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -66.26 -32.93 74.65 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -169.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -145.4 -53.8 0.29 Allowed 'General case' 0 C--O 1.231 0.123 0 O-C-N 123.251 0.344 . . . . 0.0 111.857 -168.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 158.42 170.15 22.75 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -178.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -56.42 133.06 55.67 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.841 2.361 . . . . 0.0 112.857 -170.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.443 ' CE1' ' HB3' ' A' ' 49' ' ' SER . 7.6 m-85 -86.99 85.88 7.28 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 113.97 -1.468 . . . . 0.0 107.391 -176.514 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 110.44 106.09 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 131.43 3.892 . . . . 0.0 111.163 168.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.1 mm -127.13 137.29 58.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 172.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -121.54 -31.17 4.08 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.309 0.644 . . . . 0.0 111.55 -170.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.56 160.1 27.95 Favored Pre-proline 0 C--O 1.236 0.343 0 C-N-CA 125.443 1.497 . . . . 0.0 107.046 176.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -50.92 113.31 1.03 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.53 2.153 . . . . 0.0 109.66 169.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 101.52 -6.19 55.2 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-O 117.528 -1.707 . . . . 0.0 114.538 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.4 t -130.45 127.49 62.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 120.036 1.918 . . . . 0.0 110.051 -169.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.62 166.33 16.91 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 126.214 1.805 . . . . 0.0 109.899 176.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.405 ' CE ' HD11 ' A' ' 118' ' ' LEU . 2.0 ttm -140.53 60.33 13.64 Favored Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 176.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 141.0 59.21 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.824 1.683 . . . . 0.0 113.755 -171.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -177.02 153.88 1.03 Allowed 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 128.537 2.735 . . . . 0.0 106.176 -170.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.82 160.52 38.3 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 126.41 1.884 . . . . 0.0 107.46 172.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.3 mtm105 -55.32 143.89 53.92 Favored Pre-proline 0 CA--C 1.535 0.398 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.838 177.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -45.94 -41.36 20.56 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.721 2.947 . . . . 0.0 113.335 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -61.77 -13.53 24.39 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.052 1.341 . . . . 0.0 113.288 -176.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 62.6 m -76.3 -3.99 39.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.463 0.705 . . . . 0.0 111.785 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.92 18.19 2.16 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.236 -1.313 . . . . 0.0 112.941 175.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.55 147.1 53.97 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 119.529 1.665 . . . . 0.0 109.107 169.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.4 mt -129.71 -29.74 2.12 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.356 1.062 . . . . 0.0 111.045 -173.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.478 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 87.9 mttt -143.58 157.78 44.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 125.707 1.603 . . . . 0.0 107.739 175.431 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.7 m -88.84 126.09 35.21 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.79 -178.4 39.79 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.019 0.819 . . . . 0.0 111.793 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 50.2 mtp -143.77 169.22 18.18 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 125.37 1.468 . . . . 0.0 111.132 -176.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.1 m -155.61 162.96 40.53 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.861 1.264 . . . . 0.0 109.444 169.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 mp -124.92 136.45 53.78 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 128.108 2.563 . . . . 0.0 107.141 -177.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 88.0 m -134.28 136.29 43.45 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 175.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.2 tp -129.06 144.59 51.24 Favored 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 123.346 0.404 . . . . 0.0 110.248 171.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -114.24 143.48 44.77 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.139 1.375 . . . . 0.0 109.735 174.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -74.95 -33.31 61.92 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 168.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -125.43 94.91 4.28 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.567 1.947 . . . . 0.0 107.324 174.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -56.81 162.35 7.06 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.188 0.899 . . . . 0.0 112.589 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 92.7 t -130.78 145.99 34.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 -173.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -105.21 172.27 6.88 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.733 0.813 . . . . 0.0 109.374 -174.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -124.19 157.18 65.08 Favored Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 124.718 1.207 . . . . 0.0 113.202 -169.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -63.12 -4.89 6.93 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.668 2.912 . . . . 0.0 115.441 -176.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -135.8 16.61 3.99 Favored Glycine 0 CA--C 1.532 1.151 0 CA-C-N 119.418 1.008 . . . . 0.0 113.238 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -153.94 109.74 3.23 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 119.199 1.499 . . . . 0.0 107.856 172.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -73.8 -22.28 59.86 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -171.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.4 tp10 -76.44 127.02 85.54 Favored Pre-proline 0 N--CA 1.437 -1.123 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -71.8 149.84 54.82 Favored 'Trans proline' 0 N--CA 1.449 -1.137 0 C-N-CA 122.257 1.971 . . . . 0.0 110.58 -179.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 39.9 mm -105.36 123.85 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -91.08 -22.63 20.63 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.291 -1.337 . . . . 0.0 111.043 170.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 40.7 tp -132.07 128.7 38.77 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.293 1.406 . . . . 0.0 110.649 -169.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.4 mp -132.02 138.05 48.07 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -178.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 6.0 mt -123.43 107.53 19.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -71.23 147.99 43.47 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 174.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.414 HD12 HD21 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -144.57 135.45 24.93 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 169.75 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.9 p -129.4 148.28 51.3 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 125.751 1.62 . . . . 0.0 106.793 168.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.84 133.24 21.85 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 118.88 0.764 . . . . 0.0 109.568 -177.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.71 -20.09 61.28 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.892 0.477 . . . . 0.0 111.878 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -147.58 152.62 38.25 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.381 1.072 . . . . 0.0 109.364 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.86 -32.87 71.09 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -175.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -77.9 -30.45 50.7 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 119.416 1.007 . . . . 0.0 111.32 178.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 7.9 m -64.76 -37.17 86.7 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.739 -0.6 . . . . 0.0 109.983 169.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -47.07 86.55 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 124.063 0.945 . . . . 0.0 110.185 170.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.5 mm -58.37 -49.45 81.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -57.39 -41.68 93.31 Favored Glycine 0 CA--C 1.532 1.103 0 CA-C-N 118.97 0.805 . . . . 0.0 111.924 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.28 -45.67 65.86 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.524 0.73 . . . . 0.0 111.213 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.0 mm -55.08 -46.71 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 124.86 1.264 . . . . 0.0 108.02 174.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -68.41 -9.87 51.35 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.422 1.089 . . . . 0.0 112.348 -177.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -95.95 -43.22 7.91 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 124.593 1.157 . . . . 0.0 110.834 171.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.414 HD21 HD12 ' A' ' 103' ' ' LEU . 4.4 pp -76.05 -26.62 56.73 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 118.376 0.534 . . . . 0.0 111.407 -175.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.6 p -59.4 -21.98 60.73 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.089 173.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -65.61 -20.4 66.3 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.137 0.881 . . . . 0.0 110.182 172.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 23.1 mt -102.2 -60.86 1.47 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.319 1.447 . . . . 0.0 111.037 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.79 -31.9 68.83 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.986 1.314 . . . . 0.0 113.802 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 59.6 m -104.58 26.74 8.67 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 118.641 0.655 . . . . 0.0 110.74 -174.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -132.29 97.9 4.25 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.0 -28.11 55.77 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.572 0.749 . . . . 0.0 112.263 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -65.61 -44.02 87.85 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.07 0.548 . . . . 0.0 110.142 176.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.64 -42.54 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 123.595 0.758 . . . . 0.0 108.998 175.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 62.2 mt -55.24 -43.87 74.98 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-O 118.711 -0.662 . . . . 0.0 110.595 -177.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -65.96 -40.8 91.62 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 118.605 0.639 . . . . 0.0 110.787 178.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.497 ' HB3' HD11 ' A' ' 143' ' ' ILE . 47.6 mt-30 -69.97 -29.0 66.0 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.504 0.593 . . . . 0.0 110.877 -175.415 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 34.5 mt -75.77 -52.73 9.78 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.942 0.897 . . . . 0.0 109.195 169.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 38.5 mt -57.61 -20.66 34.35 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.97 0.908 . . . . 0.0 113.294 -176.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 76.4 p -114.25 10.85 17.3 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.679 1.192 . . . . 0.0 111.249 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.98 110.92 1.48 Allowed 'General case' 0 C--N 1.344 0.35 0 C-N-CA 124.167 0.987 . . . . 0.0 110.287 -179.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 10.5 m -74.67 -10.84 59.91 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.567 0.747 . . . . 0.0 112.157 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 3.6 p -158.1 152.64 24.72 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.997 0.817 . . . . 0.0 108.997 -172.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -59.26 -34.96 72.87 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.634 1.174 . . . . 0.0 110.774 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -35.21 60.15 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 124.561 1.144 . . . . 0.0 113.819 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -73.14 -34.92 66.38 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 123.447 0.699 . . . . 0.0 110.173 -177.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 mp -61.9 -46.31 89.93 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-N 119.978 1.263 . . . . 0.0 109.019 172.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.71 -29.93 71.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.479 0.712 . . . . 0.0 112.637 177.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -68.63 -44.85 73.35 Favored 'General case' 0 C--N 1.332 -0.163 0 O-C-N 121.169 -0.957 . . . . 0.0 110.421 174.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.497 HD11 ' HB3' ' A' ' 130' ' ' GLN . 68.8 mt -62.34 -38.58 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 C-N-CA 124.229 1.011 . . . . 0.0 109.884 177.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ILE . . . . . 0.425 HG21 ' CD1' ' A' ' 7' ' ' PHE . 12.7 mm -55.79 -56.15 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.062 0 C-N-CA 123.722 0.809 . . . . 0.0 109.289 169.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 40.7 m -64.36 -26.46 68.48 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.887 0.475 . . . . 0.0 111.279 -170.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -58.94 -27.88 65.72 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.836 1.654 . . . . 0.0 113.362 173.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.936 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 -173.957 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.2 tpp . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.96 114.52 3.12 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 168.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -56.92 -43.57 81.55 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.978 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.97 -26.37 14.99 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.407 1.483 . . . . 0.0 112.955 -176.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -59.43 -28.55 67.05 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 118.888 0.767 . . . . 0.0 111.971 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -91.21 -12.56 34.94 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 117.545 -1.217 . . . . 0.0 112.859 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -114.02 85.66 10.35 Favored Pre-proline 0 N--CA 1.473 0.703 0 CA-C-N 121.607 2.003 . . . . 0.0 107.832 -173.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -57.92 -53.64 4.15 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.224 2.616 . . . . 0.0 116.412 -169.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.523 ' C ' ' H ' ' A' ' 11' ' ' SER . 41.6 tt0 -159.64 -88.3 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.041 0.837 . . . . 0.0 113.191 -169.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.9 m -68.77 16.23 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.884 1.674 . . . . 0.0 111.162 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.523 ' H ' ' C ' ' A' ' 9' ' ' GLU . 8.7 m -76.92 10.08 2.51 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 128.174 2.589 . . . . 0.0 112.785 -168.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.6 mm -139.4 130.11 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 N-CA-C 104.071 -2.566 . . . . 0.0 104.071 -171.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.6 m -157.24 136.39 11.86 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 119.625 1.102 . . . . 0.0 110.621 171.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.6 p -106.03 139.66 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 168.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.8 mt -135.89 143.86 35.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 124.255 1.022 . . . . 0.0 108.315 -168.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 39.6 m80 -67.95 -35.22 78.02 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.925 0.49 . . . . 0.0 111.959 177.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -174.42 144.23 0.89 Allowed 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.201 1.8 . . . . 0.0 106.431 176.459 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.411 ' HB3' HG21 ' A' ' 88' ' ' VAL . . . -80.3 150.24 30.04 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 169.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -59.41 -41.29 89.16 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.127 0.571 . . . . 0.0 110.977 -178.11 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -167.16 -176.24 3.25 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 126.531 1.933 . . . . 0.0 108.052 172.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 24.1 p-90 -68.69 -30.73 69.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.897 0.771 . . . . 0.0 112.817 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.504 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.0 mt-30 -60.83 -47.51 86.01 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 171.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.87 -35.71 79.12 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 121.201 -0.937 . . . . 0.0 111.666 176.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.0 -34.07 77.17 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.881 -0.512 . . . . 0.0 110.65 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.72 -46.52 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 171.72 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -56.46 -46.59 80.3 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 118.227 0.467 . . . . 0.0 110.331 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -62.98 -34.34 77.33 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 117.98 -1.01 . . . . 0.0 111.561 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.2 m -63.85 -21.72 66.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.937 1.244 . . . . 0.0 112.484 174.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.0 mmt -123.51 -17.58 6.44 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -169.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -58.25 -35.4 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 120.3 1.409 . . . . 0.0 112.399 -169.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 m -60.48 -36.19 77.7 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 119.217 0.917 . . . . 0.0 110.819 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.6 mt -78.62 -40.44 34.33 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.152 0.981 . . . . 0.0 109.199 178.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 43.0 tp -56.99 -40.97 77.55 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.337 0.517 . . . . 0.0 110.24 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -68.11 -32.44 72.75 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 124.733 1.213 . . . . 0.0 113.252 -172.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -96.68 17.89 15.49 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.31 0.505 . . . . 0.0 110.672 172.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.43 0.0 OUTLIER 44.18 40.85 3.83 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.579 2.351 . . . . 0.0 115.979 -171.27 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -66.71 -20.4 65.96 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.195 -0.941 . . . . 0.0 109.372 167.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.7 pt -143.57 168.87 11.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 C-N-CA 126.928 2.091 . . . . 0.0 108.419 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 64.4 p -101.13 165.88 11.07 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.831 1.252 . . . . 0.0 108.889 169.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.4 -30.29 70.46 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.266 -0.897 . . . . 0.0 111.86 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -59.46 -33.68 71.59 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 121.931 -0.481 . . . . 0.0 111.604 177.161 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -59.84 -41.68 91.92 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.344 0.658 . . . . 0.0 111.199 -177.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.6 mp -59.26 -49.51 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -67.36 -29.17 68.64 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 121.61 -0.681 . . . . 0.0 112.757 -178.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.11 -43.48 78.19 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.688 0.676 . . . . 0.0 110.907 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 51.1 mt -69.36 -44.75 80.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 178.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.504 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.8 mttt -63.22 -41.08 99.08 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.611 -0.681 . . . . 0.0 111.077 -176.197 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.16 -39.61 94.36 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.316 1.046 . . . . 0.0 110.623 176.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.0 m -62.59 -36.86 84.05 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.996 -0.44 . . . . 0.0 110.539 172.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 23.9 m -67.83 -38.84 83.72 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.479 0.712 . . . . 0.0 110.39 177.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 79.9 mt -63.69 -41.5 92.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-N 118.901 0.773 . . . . 0.0 110.027 172.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -65.9 -35.2 79.96 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.304 0.642 . . . . 0.0 112.483 -171.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -149.88 -49.26 0.14 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 122.85 0.46 . . . . 0.0 111.759 -168.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 150.31 179.9 26.49 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 109.134 -1.586 . . . . 0.0 109.134 -173.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -61.81 123.4 12.58 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.573 2.182 . . . . 0.0 108.697 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -78.93 -13.64 59.68 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.102 -172.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -134.21 99.36 4.37 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.197 0.999 . . . . 0.0 108.383 -169.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.6 mm -133.16 140.38 47.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -114.84 -31.62 6.06 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.025 0.53 . . . . 0.0 111.164 175.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -156.45 158.56 31.5 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 125.469 1.508 . . . . 0.0 107.376 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.12 124.09 9.76 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.473 2.115 . . . . 0.0 110.104 169.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.66 -0.08 88.01 Favored Glycine 0 CA--C 1.537 1.417 0 CA-C-O 117.791 -1.561 . . . . 0.0 115.077 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.3 t -127.78 111.08 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 119.986 1.893 . . . . 0.0 108.033 -176.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -107.74 167.65 9.82 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 123.881 0.872 . . . . 0.0 110.027 174.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.4 ttm -141.05 61.58 14.68 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 176.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -52.17 143.04 43.57 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 121.901 1.734 . . . . 0.0 113.902 -171.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -178.4 154.33 0.8 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 128.472 2.709 . . . . 0.0 106.388 -170.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -136.65 153.28 50.96 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.961 1.704 . . . . 0.0 107.621 169.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 38.2 mtm105 -53.56 143.16 38.81 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.33 -178.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -45.5 -43.17 18.05 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.901 3.067 . . . . 0.0 114.145 -171.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.2 -13.53 18.81 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.687 1.195 . . . . 0.0 113.975 -177.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.1 m -75.88 -7.15 53.85 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.774 0.83 . . . . 0.0 111.954 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 135.75 14.21 1.03 Allowed Glycine 0 CA--C 1.525 0.705 0 CA-C-O 118.434 -1.203 . . . . 0.0 113.547 177.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.87 144.79 52.41 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 119.904 1.852 . . . . 0.0 109.304 169.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.5 mt -129.68 -32.71 1.89 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 124.854 1.261 . . . . 0.0 110.479 -173.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -143.39 164.76 29.38 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 126.149 1.78 . . . . 0.0 107.968 174.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.6 m -97.07 130.94 44.3 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 123.218 0.607 . . . . 0.0 110.587 -178.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.46 -179.07 45.77 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 124.954 1.264 . . . . 0.0 110.737 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 47.1 mtt -143.9 171.09 14.71 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 126.46 1.904 . . . . 0.0 110.706 -175.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.85 161.7 41.3 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 126.427 1.891 . . . . 0.0 107.872 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.3 tp -141.54 117.56 10.57 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.336 1.855 . . . . 0.0 107.274 -172.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 69.6 m -123.37 141.72 51.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.423 HD11 ' HA ' ' A' ' 132' ' ' LEU . 13.9 tp -133.25 146.35 51.34 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 171.235 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.17 135.61 53.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.368 1.067 . . . . 0.0 108.573 174.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.05 -40.55 87.14 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 168.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -123.06 94.01 4.13 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.758 2.023 . . . . 0.0 106.825 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -53.93 160.98 4.02 Favored Glycine 0 CA--C 1.526 0.754 0 C-N-CA 124.885 1.231 . . . . 0.0 113.491 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.411 HG21 ' HB3' ' A' ' 18' ' ' ALA . 76.0 t -123.73 149.87 27.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -112.21 108.64 17.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.079 0.466 . . . . 0.0 111.832 -167.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -63.84 152.46 86.81 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 169.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -74.46 49.68 2.14 Favored 'Trans proline' 0 CA--C 1.549 1.253 0 C-N-CA 123.918 3.079 . . . . 0.0 113.044 176.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 174.67 51.23 0.05 OUTLIER Glycine 0 CA--C 1.529 0.93 0 O-C-N 120.762 -1.211 . . . . 0.0 113.748 177.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -137.45 172.31 13.17 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.626 1.213 . . . . 0.0 110.198 169.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -73.88 -31.93 63.36 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.143 -0.348 . . . . 0.0 111.607 173.344 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -151.16 167.07 13.7 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 124.306 1.042 . . . . 0.0 111.97 -176.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -53.9 134.06 57.56 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.396 2.731 . . . . 0.0 111.809 174.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 26.4 mm -72.79 128.55 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 175.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -104.74 -15.38 15.25 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 117.239 -1.363 . . . . 0.0 111.134 170.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 48.9 tp -141.1 132.11 26.16 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 120.467 1.485 . . . . 0.0 109.645 -171.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.8 mp -137.47 132.43 33.32 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.657 ' HB ' HD11 ' A' ' 122' ' ' LEU . 3.0 mt -112.94 117.21 54.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 168.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.51 147.41 35.62 Favored Glycine 0 N--CA 1.443 -0.852 0 N-CA-C 108.465 -1.854 . . . . 0.0 108.465 169.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.445 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -141.95 138.65 32.11 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 103.277 -2.86 . . . . 0.0 103.277 169.088 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.445 ' N ' HD23 ' A' ' 103' ' ' LEU . 5.2 m -140.71 143.99 35.34 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 169.41 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.23 136.96 26.98 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 118.399 0.545 . . . . 0.0 109.734 -169.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.92 -22.05 59.82 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.03 0.532 . . . . 0.0 112.097 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -146.31 155.54 42.71 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.973 0.909 . . . . 0.0 109.758 -178.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.43 74.29 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -177.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.59 -31.58 62.08 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 120.807 -1.183 . . . . 0.0 110.946 177.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.7 m -64.49 -39.33 93.6 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.993 -0.442 . . . . 0.0 110.161 170.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.9 t60 -58.8 -48.84 79.87 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 123.541 0.737 . . . . 0.0 110.054 171.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 12.2 mm -56.01 -53.02 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.472 0.709 . . . . 0.0 109.168 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.24 -39.35 94.47 Favored Glycine 0 CA--C 1.529 0.966 0 CA-C-N 118.931 0.787 . . . . 0.0 111.929 -177.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.84 -53.48 21.18 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.506 1.122 . . . . 0.0 110.64 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.3 mm -49.89 -47.54 22.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 125.746 1.619 . . . . 0.0 108.883 173.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -67.72 -10.95 57.02 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.427 -0.795 . . . . 0.0 112.384 -177.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.35 -48.33 6.72 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.146 0.979 . . . . 0.0 109.509 170.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.481 HD12 ' N ' ' A' ' 119' ' ' SER . 1.9 pp -70.33 -22.73 62.77 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -176.325 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.481 ' N ' HD12 ' A' ' 118' ' ' LEU . 44.2 m -63.18 -23.24 67.34 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 123.522 0.729 . . . . 0.0 111.475 173.069 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -66.84 -17.45 64.89 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.522 -0.736 . . . . 0.0 110.122 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 38.0 mt -108.1 -61.87 1.52 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.822 1.249 . . . . 0.0 110.951 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.657 HD11 ' HB ' ' A' ' 101' ' ' ILE . 72.8 mt -69.63 -8.62 49.14 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.21 1.404 . . . . 0.0 114.206 -173.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.1 m -120.09 27.68 8.51 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.843 0.857 . . . . 0.0 110.64 175.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -131.44 101.62 5.6 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 125.316 1.446 . . . . 0.0 107.515 176.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -56.8 -27.62 60.13 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.657 0.783 . . . . 0.0 112.217 -177.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -63.13 -48.53 78.12 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 123.465 0.706 . . . . 0.0 109.789 176.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.28 -43.26 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 C-N-CA 123.945 0.898 . . . . 0.0 109.016 177.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.46 HD21 ' HA ' ' A' ' 122' ' ' LEU . 47.5 mt -55.73 -43.2 76.34 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.989 -175.008 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -66.99 -38.9 86.87 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.479 0.581 . . . . 0.0 110.711 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -70.97 -34.7 71.68 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 118.78 0.718 . . . . 0.0 109.863 -175.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 35.1 mt -67.91 -54.35 19.49 Favored 'General case' 0 C--O 1.224 -0.27 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 170.062 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' LEU . . . . . 0.423 ' HA ' HD11 ' A' ' 83' ' ' LEU . 29.5 mt -56.57 -23.61 41.59 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -175.152 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 69.6 p -109.45 5.62 23.51 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.434 1.093 . . . . 0.0 111.876 -178.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.03 106.33 0.82 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 124.271 1.028 . . . . 0.0 110.68 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.5 p -75.55 -1.86 26.38 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.033 1.333 . . . . 0.0 112.999 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 21.4 p -149.78 155.4 40.05 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.04 0.936 . . . . 0.0 110.714 -177.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -58.62 -39.28 80.03 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.506 1.122 . . . . 0.0 109.577 173.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -34.26 74.93 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.06 -178.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -63.17 -44.14 96.3 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.603 0.638 . . . . 0.0 110.941 174.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.6 mt -63.54 -49.07 74.9 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.56 -35.13 71.87 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 173.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -66.74 -43.09 85.11 Favored 'General case' 0 C--N 1.331 -0.197 0 O-C-N 120.962 -1.086 . . . . 0.0 109.86 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 82.9 mt -66.75 -35.16 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 C-N-CA 123.661 0.784 . . . . 0.0 109.199 179.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.1 mm -58.54 -53.14 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 169.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 25.3 m -63.0 -28.76 70.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 122.747 0.419 . . . . 0.0 111.61 -171.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -60.01 -28.28 67.59 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 126.212 1.805 . . . . 0.0 113.565 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.869 0 CA-C-O 117.935 -1.481 . . . . 0.0 109.5 -173.245 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.222 0.058 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -66.21 110.21 2.93 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 173.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -59.46 -32.63 70.41 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 171.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.58 -18.47 11.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.103 0.961 . . . . 0.0 112.443 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -66.09 -22.45 66.4 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 118.883 0.765 . . . . 0.0 112.772 176.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -102.76 -4.85 24.38 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 117.039 -1.458 . . . . 0.0 114.215 -169.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -116.16 88.07 21.43 Favored Pre-proline 0 N--CA 1.475 0.815 0 CA-C-N 122.116 2.234 . . . . 0.0 109.245 -170.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_exo -40.65 -73.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.808 1 C-N-CA 125.723 4.282 . . . . 0.0 116.448 -174.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.448 ' C ' ' H ' ' A' ' 11' ' ' SER . 37.2 tt0 -163.32 -76.72 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.832 0.853 . . . . 0.0 111.252 -171.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.67 6.8 0.58 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.774 1.63 . . . . 0.0 111.914 175.336 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . 0.448 ' H ' ' C ' ' A' ' 9' ' ' GLU . 3.5 m -73.94 -0.85 17.43 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.571 2.348 . . . . 0.0 113.626 -168.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.6 mt -133.48 134.5 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 -169.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.7 m -156.41 151.71 26.62 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.496 0.718 . . . . 0.0 110.939 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.9 t -118.74 142.22 34.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 169.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.421 HG22 ' H ' ' A' ' 17' ' ' SER . 15.3 mt -139.41 147.69 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.227 1.811 . . . . 0.0 106.216 -171.138 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -68.65 -45.54 71.5 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.231 -0.918 . . . . 0.0 110.375 169.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.421 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -170.6 145.95 2.63 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.918 1.687 . . . . 0.0 106.455 -177.861 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.29 159.22 27.32 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 174.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt -59.09 -35.7 73.86 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.404 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -164.6 -179.28 5.84 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 127.328 2.251 . . . . 0.0 106.8 170.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 41.8 p-90 -64.97 -33.78 76.86 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.209 -0.932 . . . . 0.0 112.194 171.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.443 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 48.8 mt-30 -55.27 -45.23 76.15 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.75 1.22 . . . . 0.0 108.485 170.009 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -71.04 -33.56 70.41 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 121.23 -0.919 . . . . 0.0 110.817 177.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.42 -35.08 79.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 121.573 -0.704 . . . . 0.0 110.786 -178.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.94 -47.07 86.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 170.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.46 -42.24 82.13 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 118.469 0.577 . . . . 0.0 110.604 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -64.68 -33.1 75.16 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.167 0.987 . . . . 0.0 111.614 173.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.9 m -67.16 -17.97 65.07 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.831 1.196 . . . . 0.0 112.03 173.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.1 mmt -125.57 -23.48 4.06 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -168.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 p -60.25 -36.91 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 120.837 1.653 . . . . 0.0 111.684 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.0 m -67.16 -19.54 65.61 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 118.594 0.634 . . . . 0.0 112.119 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 79.9 mt -86.33 -43.46 12.86 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.908 0.883 . . . . 0.0 109.115 169.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 35.8 tp -56.61 -43.2 79.94 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.92 0.888 . . . . 0.0 110.66 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -67.65 -23.49 65.34 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 125.865 1.666 . . . . 0.0 113.931 -171.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -114.49 26.1 10.5 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.057 0.389 . . . . 0.0 110.592 171.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 60.82 26.38 16.22 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 170.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.405 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 68.0 m-85 -66.97 -23.05 65.9 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.165 -0.959 . . . . 0.0 110.647 169.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.5 pt -142.06 179.61 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 126.702 2.001 . . . . 0.0 107.975 178.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.8 p -123.17 162.65 22.13 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.816 1.646 . . . . 0.0 108.727 170.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.05 -31.68 67.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.06 0.944 . . . . 0.0 113.076 -169.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -60.16 -33.5 72.27 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.746 -0.596 . . . . 0.0 111.794 177.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -59.48 -41.51 89.97 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.722 0.809 . . . . 0.0 110.647 -177.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.12 -52.09 64.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 123.446 0.699 . . . . 0.0 109.552 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.0 mm100 -68.9 -26.84 65.3 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -176.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.71 -41.37 73.71 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.024 0.829 . . . . 0.0 111.03 173.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 33.5 mt -70.29 -45.65 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.443 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.5 mttt -66.64 -39.9 88.47 Favored 'General case' 0 C--O 1.224 -0.266 0 O-C-N 121.989 -0.444 . . . . 0.0 111.445 -175.528 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.45 -41.43 98.73 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.24 1.016 . . . . 0.0 110.301 178.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -64.83 -40.85 95.84 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.411 0.684 . . . . 0.0 110.508 173.204 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 27.8 m -60.07 -40.26 88.9 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.606 -0.684 . . . . 0.0 111.2 174.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 64.1 mt -68.88 -48.02 72.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 119.324 0.966 . . . . 0.0 110.009 176.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -74.64 -32.69 62.36 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -169.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -130.25 -52.45 1.11 Allowed 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.732 0.813 . . . . 0.0 110.29 -169.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.81 175.44 15.26 Favored Glycine 0 CA--C 1.527 0.843 0 N-CA-C 110.358 -1.097 . . . . 0.0 110.358 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -54.63 122.09 10.96 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.807 2.338 . . . . 0.0 108.061 170.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -121.14 9.53 10.51 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -169.219 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -132.28 92.4 3.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 169.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.5 mm -138.24 134.19 44.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 104.77 -2.308 . . . . 0.0 104.77 -174.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -123.71 -28.5 3.84 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 123.468 0.707 . . . . 0.0 111.261 -169.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.22 162.91 23.16 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 125.717 1.607 . . . . 0.0 107.322 175.266 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.1 117.98 3.22 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.694 2.263 . . . . 0.0 110.893 169.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.85 1.01 77.42 Favored Glycine 0 CA--C 1.53 0.97 0 CA-C-O 117.931 -1.483 . . . . 0.0 114.064 178.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.3 t -128.9 118.91 48.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 119.803 1.801 . . . . 0.0 108.698 -169.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -121.31 166.89 13.39 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.554 1.542 . . . . 0.0 110.104 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.0 ttm -135.8 60.63 37.1 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 123.166 0.586 . . . . 0.0 110.163 172.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -59.3 121.22 9.54 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 121.946 1.764 . . . . 0.0 110.15 -171.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -172.5 162.49 5.28 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 127.634 2.374 . . . . 0.0 107.173 -169.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.87 172.42 13.04 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.709 1.204 . . . . 0.0 109.867 -174.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -58.5 154.01 36.28 Favored Pre-proline 0 CA--C 1.537 0.467 0 CA-C-O 118.468 -0.777 . . . . 0.0 109.605 173.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.55 -40.03 83.74 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.462 2.108 . . . . 0.0 109.972 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -64.61 -12.59 47.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.402 1.481 . . . . 0.0 112.94 -176.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 80.9 m -77.34 -5.37 49.35 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.777 0.717 . . . . 0.0 111.965 178.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 130.69 18.44 1.41 Allowed Glycine 0 CA--C 1.524 0.607 0 CA-C-O 118.405 -1.219 . . . . 0.0 113.112 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.09 146.07 53.81 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 119.281 1.541 . . . . 0.0 109.026 169.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.8 mt -132.77 -29.47 1.5 Allowed 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 123.973 0.909 . . . . 0.0 111.183 -173.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.405 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 64.5 mttt -147.17 156.15 42.73 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.031 1.332 . . . . 0.0 107.827 177.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 93.7 m -88.28 128.57 35.48 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 123.04 0.536 . . . . 0.0 111.057 -176.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -176.92 -178.8 46.95 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.347 1.451 . . . . 0.0 110.854 -176.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.659 ' SD ' HD21 ' A' ' 118' ' ' LEU . 53.5 mtt -148.57 172.46 14.49 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 127.018 2.127 . . . . 0.0 110.077 -175.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.7 m -152.75 168.21 26.45 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.209 1.403 . . . . 0.0 109.157 169.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.421 HD22 HD11 ' A' ' 144' ' ' ILE . 12.9 tp -145.59 125.51 13.56 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.448 1.899 . . . . 0.0 108.737 -169.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 73.2 m -133.56 145.33 49.99 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.974 1.31 . . . . 0.0 108.296 -176.319 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.472 HD23 ' N ' ' A' ' 84' ' ' LEU . 5.6 tt -136.29 132.77 36.16 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 174.259 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.472 ' N ' HD23 ' A' ' 83' ' ' LEU . 9.2 mp -114.09 121.31 43.44 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 126.865 2.066 . . . . 0.0 106.376 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -60.77 -36.91 80.17 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.247 0.93 . . . . 0.0 112.745 -177.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -92.96 -14.93 26.86 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.286 0.634 . . . . 0.0 112.156 176.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.97 -176.44 21.67 Favored Glycine 0 CA--C 1.534 1.271 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 -168.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.2 p -150.66 164.43 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 O-C-N 121.663 -0.904 . . . . 0.0 108.659 169.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -102.37 110.71 22.74 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.458 0.647 . . . . 0.0 109.837 -169.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -82.65 118.89 73.34 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 125.594 1.558 . . . . 0.0 108.118 170.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -61.63 112.96 1.61 Allowed 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 123.181 2.587 . . . . 0.0 110.847 -170.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 126.81 -17.85 6.34 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 124.588 1.089 . . . . 0.0 112.887 -178.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -132.57 97.72 4.15 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 174.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.33 -27.49 67.39 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -169.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -68.29 128.44 93.15 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.53 129.86 18.6 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.295 1.997 . . . . 0.0 109.22 -176.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 31.4 mm -72.38 107.74 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 178.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 32.0 mtpt -84.59 -18.86 34.2 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-O 117.094 -1.431 . . . . 0.0 111.513 171.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 8.4 mt -137.97 139.24 39.6 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 120.703 1.592 . . . . 0.0 111.837 -174.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mp -140.7 134.63 30.63 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 -175.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.64 HG21 HD22 ' A' ' 118' ' ' LEU . 5.0 mt -119.94 126.49 75.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 169.404 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.18 153.58 28.01 Favored Glycine 0 CA--C 1.522 0.517 0 N-CA-C 108.834 -1.706 . . . . 0.0 108.834 169.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.516 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -149.99 144.26 25.72 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 105.344 -2.095 . . . . 0.0 105.344 173.877 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.516 ' N ' HD23 ' A' ' 103' ' ' LEU . 79.5 p -142.29 146.38 35.01 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 105.565 -2.013 . . . . 0.0 105.565 168.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.665 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -144.15 148.17 34.67 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 171.018 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -83.78 -13.85 52.88 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.012 -174.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -135.5 152.53 51.42 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.619 0.768 . . . . 0.0 110.171 174.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.27 -35.23 76.73 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -177.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -72.22 -31.17 65.61 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.09 -1.006 . . . . 0.0 110.808 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.505 ' HB2' ' HB1' ' A' ' 105' ' ' ALA . 16.3 m -63.84 -38.82 92.52 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 118.719 -0.658 . . . . 0.0 109.658 169.675 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.665 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 24.8 m-70 -61.93 -43.33 99.07 Favored 'General case' 0 C--N 1.344 0.345 0 CA-C-N 119.401 1.0 . . . . 0.0 110.767 172.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.8 mm -57.82 -55.57 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 119.428 1.013 . . . . 0.0 109.331 177.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -58.92 -39.32 93.92 Favored Glycine 0 CA--C 1.528 0.849 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.435 ' CB ' HD21 ' A' ' 103' ' ' LEU . . . -67.51 -49.05 65.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.308 1.043 . . . . 0.0 111.267 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.4 mm -56.36 -42.95 75.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.231 1.013 . . . . 0.0 108.643 176.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -70.98 -12.35 61.49 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.75 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -82.98 -45.51 14.01 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 169.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.659 HD21 ' SD ' ' A' ' 79' ' ' MET . 92.5 mt -71.54 -26.94 62.85 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 118.887 -0.578 . . . . 0.0 112.062 -174.239 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.1 m -60.83 -24.43 65.86 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.096 0.407 . . . . 0.0 111.591 170.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.53 -16.41 62.33 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.748 -1.22 . . . . 0.0 110.688 175.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 42.2 mt -104.52 -67.56 0.9 Allowed 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.322 1.049 . . . . 0.0 109.713 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 16.9 mt -75.48 -6.35 49.71 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -171.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 33.4 m -119.86 29.7 7.42 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.175 0.898 . . . . 0.0 110.457 174.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -131.33 108.5 9.69 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 172.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -57.68 -27.38 62.83 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.632 -177.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -63.78 -45.25 90.6 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.25 0.62 . . . . 0.0 110.003 176.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.54 -41.23 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 118.409 -0.805 . . . . 0.0 109.135 175.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 35.3 mt -56.14 -39.78 72.78 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 119.34 0.973 . . . . 0.0 111.231 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -69.87 -37.33 76.05 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.01 176.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -65.35 -41.44 93.85 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 119.336 0.971 . . . . 0.0 109.106 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 22.9 mt -66.19 -52.85 44.12 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 175.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 51.1 mt -59.37 -17.4 29.66 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 77.6 p -108.24 3.2 23.36 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.629 1.172 . . . . 0.0 112.09 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.45 140.19 58.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.403 1.081 . . . . 0.0 109.257 169.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -132.46 1.84 3.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.028 1.331 . . . . 0.0 111.234 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.2 m -144.28 150.62 38.19 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.115 0.966 . . . . 0.0 109.442 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.2 -43.16 92.25 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.957 1.303 . . . . 0.0 110.649 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -60.02 -35.29 74.76 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 123.054 0.542 . . . . 0.0 111.287 177.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -64.56 -40.34 95.39 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.948 0.899 . . . . 0.0 111.161 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.1 mt -65.61 -46.15 80.4 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.31 69.27 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 174.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -65.57 -38.18 88.81 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 120.52 -1.363 . . . . 0.0 109.913 174.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 66.2 mt -69.55 -35.47 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 C-N-CA 124.141 0.976 . . . . 0.0 109.562 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ILE . . . . . 0.421 HD11 HD22 ' A' ' 81' ' ' LEU . 27.9 mm -56.26 -50.75 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 169.389 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 18.7 m -65.12 -30.61 71.55 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 123.281 0.363 . . . . 0.0 110.966 -173.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -60.11 -27.61 67.17 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.218 1.407 . . . . 0.0 113.296 172.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 N-CA-C 108.79 -1.724 . . . . 0.0 108.79 -179.028 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.467 0.175 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.21 109.01 3.38 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 172.145 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -58.36 -31.69 67.85 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.6 -21.1 2.33 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.931 1.692 . . . . 0.0 113.319 177.186 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -64.02 -25.19 68.01 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.304 0.957 . . . . 0.0 113.468 174.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -101.19 -21.66 14.87 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -169.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -103.97 103.99 40.76 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 -170.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -59.19 -68.04 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.511 2.807 . . . . 0.0 113.968 -171.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -163.28 -74.73 0.04 OUTLIER 'General case' 0 CA--C 1.521 -0.164 0 C-N-CA 124.155 0.982 . . . . 0.0 111.028 -173.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.13 3.11 1.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.104 1.362 . . . . 0.0 111.917 177.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -15.28 63.5 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.815 1.646 . . . . 0.0 113.24 -169.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.4 mp -117.83 137.27 52.3 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 -171.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.1 m -156.97 139.86 15.26 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.572 0.624 . . . . 0.0 110.917 176.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 92.7 t -105.0 137.11 35.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 104.764 -2.31 . . . . 0.0 104.764 169.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 40.9 mt -137.74 148.81 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 -176.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -66.05 -45.82 79.99 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.584 -0.697 . . . . 0.0 110.733 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -164.9 144.39 6.98 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.815 1.246 . . . . 0.0 108.144 -176.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.23 156.75 28.0 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 169.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -60.05 -40.92 91.07 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.576 176.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -167.41 -177.49 3.63 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 128.201 2.6 . . . . 0.0 107.505 171.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -62.17 -34.15 75.88 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.479 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.5 mt-30 -60.66 -48.43 81.81 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.578 1.535 . . . . 0.0 107.906 173.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -62.64 -35.86 80.96 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 121.307 -0.871 . . . . 0.0 111.451 176.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.93 82.4 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.766 -0.584 . . . . 0.0 110.544 -178.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -65.64 -47.89 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 172.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -58.44 -48.02 82.08 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 118.434 0.561 . . . . 0.0 110.762 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -59.7 -30.01 68.49 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.287 1.035 . . . . 0.0 111.356 174.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 31.5 m -84.58 -9.91 57.87 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 119.383 0.992 . . . . 0.0 113.565 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.2 mmt -124.72 -21.52 4.78 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 119.99 1.268 . . . . 0.0 112.757 -172.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.22 -37.28 55.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 120.489 1.495 . . . . 0.0 111.125 -175.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 m -64.48 -25.71 68.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.598 -0.689 . . . . 0.0 112.425 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.6 mt -87.51 -40.98 13.83 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.127 0.971 . . . . 0.0 109.061 175.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.2 tp -56.15 -41.72 75.84 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.563 1.145 . . . . 0.0 110.4 176.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.67 -32.64 74.31 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 125.426 1.49 . . . . 0.0 112.673 -174.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.3 mmtt -94.69 15.84 17.21 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.217 0.462 . . . . 0.0 110.818 173.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.33 3.5 p30 46.89 42.57 12.36 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.889 1.675 . . . . 0.0 114.079 -172.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -69.88 -21.84 63.29 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.501 -0.749 . . . . 0.0 109.324 168.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.6 pt -147.12 170.43 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 127.096 2.158 . . . . 0.0 108.159 -174.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.8 p -105.85 168.13 9.32 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.039 1.336 . . . . 0.0 109.187 169.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.89 -30.06 71.18 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.254 -0.904 . . . . 0.0 111.997 -175.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -60.59 -32.55 71.65 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 121.788 -0.57 . . . . 0.0 111.474 175.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -59.88 -43.42 94.74 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.539 0.609 . . . . 0.0 110.563 -177.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.1 mp -55.33 -50.11 67.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 123.315 0.646 . . . . 0.0 109.365 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -71.43 -25.38 62.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.665 -0.683 . . . . 0.0 111.923 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.58 -43.82 97.85 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 119.434 1.015 . . . . 0.0 110.801 173.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.4 mt -63.99 -45.41 96.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.8 mttt -61.62 -37.98 85.96 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 122.042 -0.411 . . . . 0.0 110.229 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.45 -43.49 94.1 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 119.083 0.856 . . . . 0.0 111.33 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 49.4 m -59.12 -38.75 80.34 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.753 0.706 . . . . 0.0 110.611 171.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.5 m -64.51 -40.4 95.57 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.564 0.746 . . . . 0.0 111.064 178.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.94 -44.22 99.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 119.444 1.02 . . . . 0.0 109.122 173.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -72.61 -36.24 68.05 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -170.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -141.14 9.19 2.09 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -167.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 69.19 -169.86 42.57 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 110.038 -1.225 . . . . 0.0 110.038 -169.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -64.13 108.49 0.97 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.195 1.93 . . . . 0.0 108.085 177.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -89.56 1.08 56.42 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -169.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -130.91 108.79 10.08 Favored 'General case' 0 C--O 1.231 0.108 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 169.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.5 mm -141.01 134.54 31.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 103.114 -2.921 . . . . 0.0 103.114 -178.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mp -130.62 -21.2 2.82 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -169.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.29 160.43 30.45 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 172.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -57.67 121.36 9.89 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 121.927 1.751 . . . . 0.0 109.565 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.54 2.53 76.08 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-O 117.895 -1.503 . . . . 0.0 114.445 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.7 t -133.39 118.67 32.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-N 120.312 2.056 . . . . 0.0 109.275 -169.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -116.19 163.35 16.1 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.362 1.465 . . . . 0.0 109.818 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 7.5 ttm -137.79 61.08 27.54 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-O 118.59 -0.719 . . . . 0.0 109.862 171.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . 0.28 93.7 Cg_exo -31.22 -85.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.016 1 C-N-CA 125.786 4.324 . . . . 0.0 118.763 -168.305 . . . . . . . . 3 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 54.72 164.13 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 126.905 2.082 . . . . 0.0 114.61 -176.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -141.97 155.87 45.46 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 126.478 1.911 . . . . 0.0 106.916 170.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -50.86 147.75 8.31 Favored Pre-proline 0 CA--C 1.536 0.42 0 CA-C-O 118.08 -0.962 . . . . 0.0 110.034 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_exo -46.68 -41.97 24.18 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.217 2.611 . . . . 0.0 112.876 176.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -61.6 -14.28 29.1 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.799 1.24 . . . . 0.0 113.842 -177.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.2 m -79.84 -3.08 46.31 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.712 0.805 . . . . 0.0 112.247 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.66 18.92 1.72 Allowed Glycine 0 C--N 1.336 0.562 0 CA-C-O 118.748 -1.029 . . . . 0.0 112.959 175.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.4 148.67 49.29 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 119.468 1.634 . . . . 0.0 109.269 170.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 76.5 mt -131.9 -32.25 1.45 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 124.828 1.251 . . . . 0.0 110.77 -175.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -143.31 163.15 33.79 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.942 1.697 . . . . 0.0 107.816 178.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.3 m -97.71 122.62 41.01 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 123.189 0.596 . . . . 0.0 109.91 -177.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -168.88 179.83 41.44 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.25 1.405 . . . . 0.0 111.348 -176.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.7 ' SD ' HD21 ' A' ' 118' ' ' LEU . 52.1 mtt -149.02 168.34 23.39 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.44 1.496 . . . . 0.0 111.23 -170.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.2 p -148.54 164.91 32.8 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.454 1.502 . . . . 0.0 109.852 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.523 HD22 HD11 ' A' ' 144' ' ' ILE . 21.1 tp -146.28 90.03 1.92 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.602 1.561 . . . . 0.0 109.923 -169.517 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.1 m -97.45 143.75 27.86 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.0 tp -133.25 136.78 45.76 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 169.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -115.69 116.34 27.91 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 104.705 -2.331 . . . . 0.0 104.705 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.42 -33.44 75.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 118.701 0.682 . . . . 0.0 112.328 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -85.48 -13.43 49.14 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.919 0.888 . . . . 0.0 111.722 173.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 68.75 177.23 13.7 Favored Glycine 0 CA--C 1.533 1.181 0 N-CA-C 110.265 -1.134 . . . . 0.0 110.265 -168.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -146.12 161.15 10.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 168.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.95 103.0 11.96 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 121.409 -0.807 . . . . 0.0 110.024 -169.263 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -67.0 142.06 97.07 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 114.924 -1.035 . . . . 0.0 109.097 170.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -63.79 137.67 59.65 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.929 2.419 . . . . 0.0 111.754 -169.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 71.49 0.18 37.45 Favored Glycine 0 CA--C 1.531 1.065 0 CA-C-O 118.527 -1.152 . . . . 0.0 114.962 170.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -75.96 166.23 23.8 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.681 1.741 . . . . 0.0 110.633 178.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -64.51 -38.87 92.53 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.938 -0.476 . . . . 0.0 111.77 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -152.7 169.28 9.88 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 124.524 1.13 . . . . 0.0 112.43 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -56.16 159.74 11.98 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 124.195 3.263 . . . . 0.0 114.041 174.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 27.0 mm -108.1 123.5 63.68 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -89.05 -32.52 17.53 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-O 116.819 -1.562 . . . . 0.0 109.878 169.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.46 HD22 HD22 ' A' ' 131' ' ' LEU . 1.9 tp -130.49 144.09 51.18 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 121.1 1.773 . . . . 0.0 112.297 -172.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.3 mp -132.95 109.16 9.38 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.008 1.323 . . . . 0.0 107.707 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.724 HG21 HD22 ' A' ' 118' ' ' LEU . 0.5 OUTLIER -87.74 115.27 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 104.72 -2.326 . . . . 0.0 104.72 168.729 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.73 153.33 29.77 Favored Glycine 0 CA--C 1.527 0.784 0 N-CA-C 109.321 -1.511 . . . . 0.0 109.321 170.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -145.35 144.35 30.65 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 103.872 -2.64 . . . . 0.0 103.872 171.372 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.434 ' N ' HD23 ' A' ' 103' ' ' LEU . 11.3 m -142.32 142.47 32.51 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 169.364 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -145.1 136.3 24.96 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -170.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.85 -24.46 52.67 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.907 0.483 . . . . 0.0 111.889 -175.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -143.53 157.41 44.46 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.896 0.878 . . . . 0.0 110.081 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.31 -35.12 73.22 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.52 -32.4 60.48 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.904 -1.122 . . . . 0.0 111.033 177.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.8 m -62.02 -42.28 99.0 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 169.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 22.2 t60 -57.71 -49.04 77.87 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.134 0.974 . . . . 0.0 110.17 173.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.4 mm -56.41 -54.98 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 118.89 0.768 . . . . 0.0 109.604 179.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.71 -38.85 94.46 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-N 118.549 0.613 . . . . 0.0 111.582 -176.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.37 -49.86 57.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.674 1.189 . . . . 0.0 110.901 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.0 mm -55.83 -42.7 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.588 1.155 . . . . 0.0 109.145 176.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.7 mm-40 -69.54 -14.59 62.93 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 118.381 -0.818 . . . . 0.0 111.936 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.85 -42.34 16.51 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 170.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.724 HD22 HG21 ' A' ' 101' ' ' ILE . 96.4 mt -68.76 -29.3 67.66 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 121.78 -0.575 . . . . 0.0 111.708 -177.727 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.1 m -56.61 -22.49 34.33 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 170.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -77.24 -18.29 57.76 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.584 1.084 . . . . 0.0 111.519 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 42.9 mt -103.51 -61.26 1.44 Allowed 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.971 0.908 . . . . 0.0 110.103 -177.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.51 -27.65 69.29 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.92 0.888 . . . . 0.0 113.046 -174.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.5 m -106.93 29.32 7.16 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.134 0.574 . . . . 0.0 110.577 -175.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -130.59 104.88 7.47 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 123.909 0.884 . . . . 0.0 108.686 175.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -58.63 -25.55 62.8 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.08 -177.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.53 -48.22 73.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 121.273 0.559 . . . . 0.0 109.564 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.59 -42.2 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 123.885 0.874 . . . . 0.0 109.013 175.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 45.5 mt -60.86 -33.91 73.8 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 118.714 0.688 . . . . 0.0 111.758 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -69.34 -43.46 73.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 120.821 -1.175 . . . . 0.0 109.587 172.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -62.95 -33.29 75.04 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.864 0.756 . . . . 0.0 110.321 -177.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.46 HD22 HD22 ' A' ' 99' ' ' LEU . 3.8 pp -81.16 -42.0 21.53 Favored 'General case' 0 C--N 1.342 0.241 0 C-N-CA 123.451 0.7 . . . . 0.0 111.2 177.28 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 55.2 mt -64.48 -20.25 66.07 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.551 1.069 . . . . 0.0 111.743 176.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 59.9 p -108.79 16.33 22.86 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.983 1.313 . . . . 0.0 111.167 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.39 102.62 0.71 Allowed 'General case' 0 C--N 1.346 0.42 0 CA-C-N 119.254 0.934 . . . . 0.0 111.18 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.3 m -71.75 -17.0 62.22 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.496 0.718 . . . . 0.0 112.272 175.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.3 p -153.76 162.44 41.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.813 0.733 . . . . 0.0 111.184 -171.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -57.61 -37.24 72.92 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.418 1.087 . . . . 0.0 109.401 169.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -58.39 -44.16 88.81 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-O 118.618 -0.706 . . . . 0.0 110.916 176.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -60.04 -38.13 81.86 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 119.122 0.874 . . . . 0.0 112.121 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 38.3 mt -69.9 -44.77 69.02 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.706 0.685 . . . . 0.0 109.971 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -65.55 -26.58 67.94 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.087 -1.008 . . . . 0.0 112.569 175.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -66.15 -35.81 81.47 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 120.344 -1.472 . . . . 0.0 110.826 174.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.44 -39.34 84.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.729 0.811 . . . . 0.0 109.784 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ILE . . . . . 0.523 HD11 HD22 ' A' ' 81' ' ' LEU . 33.7 mm -58.21 -51.51 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 173.026 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.9 m -65.57 -24.53 67.11 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.469 -169.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.472 ' HG3' HH11 ' A' ' 146' ' ' ARG . 2.2 ttm-85 -60.19 -25.29 65.46 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.398 1.479 . . . . 0.0 113.825 173.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.973 -0.904 . . . . 0.0 111.065 -173.666 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 tpt . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.43 112.84 1.91 Allowed 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 169.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.56 -34.01 73.53 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 169.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.9 p -59.53 -5.74 0.91 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.921 1.688 . . . . 0.0 113.413 171.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -109.19 11.54 25.44 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.098 1.359 . . . . 0.0 113.341 174.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -130.96 -46.63 1.02 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.34 1.056 . . . . 0.0 109.6 169.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -75.22 118.26 69.27 Favored Pre-proline 0 CA--C 1.542 0.642 0 N-CA-C 104.302 -2.481 . . . . 0.0 104.302 170.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.9 -78.71 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.646 2.231 . . . . 0.0 111.394 -169.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -168.5 165.39 12.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 128.316 2.646 . . . . 0.0 104.88 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 56.99 15.74 2.49 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.711 1.204 . . . . 0.0 113.719 171.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.5 m -117.53 28.64 8.33 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.95 1.3 . . . . 0.0 110.489 -169.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 mt -122.73 144.54 31.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 171.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 69.9 m -157.07 157.33 34.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.852 0.861 . . . . 0.0 109.488 169.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 99.2 t -122.21 141.06 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 104.248 -2.501 . . . . 0.0 104.248 170.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.5 mt -136.18 144.11 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 125.29 1.436 . . . . 0.0 107.86 -168.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -70.68 -36.04 73.11 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.159 -0.338 . . . . 0.0 111.24 177.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 p -175.11 146.41 0.85 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 126.299 1.84 . . . . 0.0 106.292 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.28 157.67 20.52 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 169.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -62.7 -37.11 85.18 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.009 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -165.2 -179.46 5.64 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 126.754 2.021 . . . . 0.0 107.125 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 69.0 p-90 -61.78 -35.17 77.37 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.882 0.765 . . . . 0.0 111.864 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.489 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 51.3 mt-30 -51.79 -53.94 34.32 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.64 1.176 . . . . 0.0 108.191 170.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -66.57 -34.39 77.78 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 121.684 -0.635 . . . . 0.0 111.185 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.24 -31.56 72.46 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 121.82 -0.55 . . . . 0.0 110.795 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.74 -48.3 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 170.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -56.51 -46.21 80.66 Favored 'General case' 0 C--O 1.223 -0.327 0 O-C-N 122.033 -0.417 . . . . 0.0 110.08 178.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -64.52 -29.32 70.35 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 118.003 -0.998 . . . . 0.0 112.293 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.2 m -66.93 -23.53 65.98 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 120.17 1.35 . . . . 0.0 111.869 172.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.1 mmt -123.79 -17.96 6.19 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 -168.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.8 p -57.17 -34.82 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 120.276 1.398 . . . . 0.0 112.472 -169.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.5 m -64.77 -44.65 89.34 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 118.654 0.661 . . . . 0.0 109.727 178.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 89.3 mt -65.05 -36.67 85.1 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.182 0.593 . . . . 0.0 109.709 177.3 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 51.1 tp -61.61 -48.25 81.76 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.22 0.608 . . . . 0.0 109.924 177.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -65.42 -37.14 86.04 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 124.157 0.983 . . . . 0.0 112.168 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -76.56 2.11 14.84 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.604 1.162 . . . . 0.0 111.859 175.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.414 0.0 OUTLIER 48.64 30.34 2.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.703 2.401 . . . . 0.0 116.019 -169.956 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -66.68 -23.66 66.16 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.11 -0.994 . . . . 0.0 109.762 168.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.0 pt -140.88 179.28 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 C-N-CA 126.063 1.745 . . . . 0.0 109.905 -177.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 m -121.09 160.53 23.47 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.899 2.08 . . . . 0.0 108.46 175.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.02 -33.23 71.72 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.318 -0.864 . . . . 0.0 112.883 -171.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -59.51 -30.82 68.84 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.864 -0.522 . . . . 0.0 111.885 176.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -61.16 -42.7 99.02 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.312 0.645 . . . . 0.0 110.574 -177.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.4 -50.38 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 174.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -68.78 -25.89 64.93 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.501 -0.762 . . . . 0.0 112.003 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.76 98.22 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 119.473 1.033 . . . . 0.0 110.909 174.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.9 mt -66.96 -44.06 88.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.489 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.6 mttt -60.9 -44.64 96.86 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.352 0.523 . . . . 0.0 109.915 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.69 -37.28 86.75 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.125 0.97 . . . . 0.0 111.47 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.0 m -63.31 -38.02 89.54 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.635 -0.666 . . . . 0.0 110.44 172.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 17.5 m -66.73 -35.38 79.98 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.434 0.694 . . . . 0.0 110.738 176.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 95.4 mt -65.11 -44.09 95.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 119.221 0.919 . . . . 0.0 109.638 171.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -64.91 -34.91 79.52 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.61 0.764 . . . . 0.0 112.561 -169.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -149.96 -48.43 0.13 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.087 0.555 . . . . 0.0 111.309 -169.122 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 146.56 -178.64 24.09 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 109.084 -1.607 . . . . 0.0 109.084 -173.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -60.19 122.66 11.7 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 122.332 2.021 . . . . 0.0 109.619 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -80.02 -17.66 52.24 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -172.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -129.57 95.69 4.06 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 -171.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.1 mm -135.2 142.42 39.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 126.6 1.96 . . . . 0.0 105.914 -174.479 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mp -132.16 -28.6 1.7 Allowed 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.38 0.672 . . . . 0.0 112.124 -173.003 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.13 164.87 20.2 Favored Pre-proline 0 C--O 1.238 0.47 0 C-N-CA 125.11 1.364 . . . . 0.0 107.596 173.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.13 123.45 11.0 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.28 1.987 . . . . 0.0 109.507 169.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.54 3.66 90.43 Favored Glycine 0 CA--C 1.535 1.338 0 CA-C-O 117.892 -1.504 . . . . 0.0 115.204 178.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 58.0 t -128.27 122.76 58.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 120.241 2.021 . . . . 0.0 108.56 -173.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.78 163.05 23.71 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 124.948 1.299 . . . . 0.0 110.262 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.2 ttm -132.8 60.46 50.11 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 123.414 0.686 . . . . 0.0 111.64 175.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -50.59 143.62 27.79 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.304 2.003 . . . . 0.0 114.432 -171.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -179.72 154.9 0.62 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 128.205 2.602 . . . . 0.0 106.672 -169.607 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.07 161.66 36.17 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 125.515 1.526 . . . . 0.0 107.631 169.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.6 ptt85 -49.93 139.56 17.08 Favored Pre-proline 0 CA--C 1.54 0.568 0 CA-C-O 118.079 -0.962 . . . . 0.0 109.729 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -46.89 -43.26 24.38 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 123.692 2.928 . . . . 0.0 113.008 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.08 -9.65 11.33 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.484 1.514 . . . . 0.0 114.368 -177.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 64.0 m -76.47 -3.91 39.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.011 0.823 . . . . 0.0 112.388 172.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 132.66 13.29 1.65 Allowed Glycine 0 C--N 1.334 0.456 0 CA-C-O 118.305 -1.275 . . . . 0.0 113.373 171.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.4 145.17 56.16 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.296 1.548 . . . . 0.0 109.231 169.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.0 mt -126.2 -33.92 2.58 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 124.444 1.098 . . . . 0.0 110.261 -175.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -139.52 168.59 19.48 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.103 1.761 . . . . 0.0 107.873 176.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 96.9 m -98.8 118.53 35.75 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 123.351 0.66 . . . . 0.0 109.247 177.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -165.63 177.82 40.7 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 123.804 0.716 . . . . 0.0 112.382 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.721 ' SD ' HD21 ' A' ' 118' ' ' LEU . 59.0 mtt -142.22 166.97 23.24 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.737 1.269 . . . . 0.0 112.841 -171.426 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.2 p -145.58 158.55 43.83 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.264 1.826 . . . . 0.0 108.762 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 mp -134.44 133.16 40.18 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.988 1.315 . . . . 0.0 107.542 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 26.6 m -139.05 134.9 33.6 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -174.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.1 tp -123.56 142.18 51.28 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 169.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.9 mp -121.34 115.98 23.95 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 126.973 2.109 . . . . 0.0 105.584 177.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -62.99 -25.03 68.19 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.115 0.966 . . . . 0.0 112.486 -174.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -110.52 -7.98 14.68 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.8 1.24 . . . . 0.0 111.765 177.089 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 59.39 -176.37 2.94 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 123.842 0.734 . . . . 0.0 112.065 -169.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -151.49 157.92 5.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 169.146 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -98.26 109.77 22.47 Favored 'General case' 0 C--N 1.333 -0.133 0 O-C-N 121.182 -0.949 . . . . 0.0 112.139 -169.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -82.85 114.74 54.43 Favored Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 106.241 -1.762 . . . . 0.0 106.241 169.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -61.34 108.13 0.56 Allowed 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.557 2.171 . . . . 0.0 110.936 -169.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 140.78 -31.19 2.23 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-O 118.808 -0.996 . . . . 0.0 113.153 177.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -69.9 162.0 28.85 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.169 1.485 . . . . 0.0 110.093 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -64.71 -32.95 74.85 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.857 -0.527 . . . . 0.0 112.072 174.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -147.24 170.2 8.13 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 124.593 1.157 . . . . 0.0 112.228 -175.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -52.33 130.76 37.21 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 123.3 2.667 . . . . 0.0 111.612 174.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 28.4 mm -69.11 119.25 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.1 mtpt -97.14 -17.35 19.97 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.851 -1.071 . . . . 0.0 110.78 174.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.434 HD21 HD13 ' A' ' 131' ' ' LEU . 59.5 tp -142.09 128.44 19.98 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 119.951 1.251 . . . . 0.0 110.412 -169.388 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.1 mp -137.82 113.56 9.71 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -170.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.724 HG21 HD22 ' A' ' 118' ' ' LEU . 1.2 mp -100.16 111.56 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 175.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.7 147.79 31.33 Favored Glycine 0 CA--C 1.529 0.954 0 N-CA-C 110.065 -1.214 . . . . 0.0 110.065 173.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.34 141.05 37.66 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 171.09 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 28.5 p -131.33 142.34 50.07 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 127.58 2.352 . . . . 0.0 106.533 171.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -145.86 133.6 21.12 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.61 -22.17 57.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 122.818 0.447 . . . . 0.0 111.42 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -145.83 154.49 42.05 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.141 0.977 . . . . 0.0 109.77 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.04 -31.69 69.07 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -177.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -77.61 -32.85 53.77 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.24 0.927 . . . . 0.0 111.373 178.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 4.4 m -60.95 -42.88 99.1 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 169.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -48.83 77.01 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.539 1.136 . . . . 0.0 110.51 171.815 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 6.0 mm -58.24 -45.56 88.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 123.37 0.668 . . . . 0.0 110.57 -177.193 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -73.96 -33.64 57.09 Favored Glycine 0 CA--C 1.529 0.917 0 CA-C-N 119.715 1.143 . . . . 0.0 111.597 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.66 -46.96 80.23 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.122 0.969 . . . . 0.0 110.886 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -54.39 -45.04 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 125.076 1.35 . . . . 0.0 108.444 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -69.19 -9.96 55.43 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 118.297 -0.858 . . . . 0.0 112.807 -178.66 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -90.36 -38.43 13.34 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 119.796 1.18 . . . . 0.0 109.056 170.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.724 HD22 HG21 ' A' ' 101' ' ' ILE . 88.6 mt -72.76 -31.82 65.2 Favored 'General case' 0 CA--C 1.517 -0.321 0 O-C-N 121.759 -0.588 . . . . 0.0 111.055 -178.347 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.2 m -61.09 -20.91 63.17 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.495 0.718 . . . . 0.0 112.108 173.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -66.95 -25.19 66.22 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.656 1.116 . . . . 0.0 110.212 174.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 41.5 mt -103.04 -61.38 1.41 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.132 0.973 . . . . 0.0 111.046 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.98 -1.22 18.94 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -172.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 37.1 m -114.91 26.47 10.13 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.6 1.091 . . . . 0.0 111.653 173.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -138.58 96.73 3.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 -172.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -58.23 -23.91 57.47 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.677 0.791 . . . . 0.0 112.501 -173.079 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -62.73 -49.59 74.43 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 121.323 0.582 . . . . 0.0 109.624 174.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.82 -40.37 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 C-N-CA 124.646 1.178 . . . . 0.0 109.51 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 31.9 mt -54.79 -43.49 72.91 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 118.574 -0.727 . . . . 0.0 111.18 -172.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -67.17 -38.15 84.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 118.693 0.679 . . . . 0.0 110.708 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLN . . . . . 0.423 ' HB3' HD11 ' A' ' 143' ' ' ILE . 62.1 mt-30 -70.17 -32.64 70.69 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.038 0.535 . . . . 0.0 110.098 -176.004 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.434 HD13 HD21 ' A' ' 99' ' ' LEU . 30.2 mt -72.78 -52.5 14.75 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 169.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.2 mt -58.59 -11.62 3.22 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.512 1.125 . . . . 0.0 113.746 -175.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 62.5 p -116.12 15.67 16.02 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.101 1.361 . . . . 0.0 110.797 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.44 95.41 0.02 OUTLIER 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.02 1.328 . . . . 0.0 110.73 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 50.7 m -82.39 -14.59 54.97 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.686 0.794 . . . . 0.0 111.099 -176.17 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.2 m -146.76 154.98 42.03 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 125.929 1.692 . . . . 0.0 106.728 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -54.88 -35.1 63.73 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.042 1.337 . . . . 0.0 111.687 178.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -53.22 -36.23 60.8 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.18 0.592 . . . . 0.0 111.988 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -64.79 -35.85 82.41 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 123.999 0.919 . . . . 0.0 112.426 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 59.3 mt -67.83 -44.12 77.95 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -75.08 -24.13 58.13 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -176.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -60.22 -44.45 95.16 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 120.736 -1.228 . . . . 0.0 109.658 171.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.423 HD11 ' HB3' ' A' ' 130' ' ' GLN . 96.6 mt -68.87 -35.53 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 C-N-CA 124.581 1.153 . . . . 0.0 109.792 -178.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.9 -49.78 72.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 122.958 0.503 . . . . 0.0 110.315 169.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 39.3 m -64.79 -27.19 68.72 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -168.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 18.3 mtt180 -69.56 -25.85 64.2 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.201 0.6 . . . . 0.0 111.596 175.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.865 0 C-N-CA 125.815 1.674 . . . . 0.0 111.449 -169.583 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 tpt . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 110.202 -0.295 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -66.1 109.28 2.54 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 168.782 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -54.02 -45.19 71.49 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.35 -19.22 5.08 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.913 1.685 . . . . 0.0 113.712 -178.032 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -66.64 -30.7 71.03 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-N 119.494 1.043 . . . . 0.0 111.967 176.621 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -86.56 -34.46 19.92 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.902 -0.571 . . . . 0.0 112.042 -174.137 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -90.08 104.47 8.7 Favored Pre-proline 0 N--CA 1.471 0.608 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 -173.491 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.05 -66.11 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 122.935 2.423 . . . . 0.0 113.863 -169.368 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -167.49 -64.73 0.03 OUTLIER 'General case' 0 C--O 1.231 0.127 0 C-N-CA 125.49 1.516 . . . . 0.0 109.792 178.817 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -69.18 5.76 1.15 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.156 1.382 . . . . 0.0 112.26 177.159 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.44 -29.84 71.06 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 126.116 1.767 . . . . 0.0 111.216 -174.019 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.1 mm -91.23 134.96 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.323 0 C-N-CA 125.734 1.613 . . . . 0.0 107.109 -169.781 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.4 m -157.27 151.52 24.94 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.238 0.926 . . . . 0.0 111.223 170.717 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 76.5 t -122.62 143.55 35.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 169.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.8 mt -140.89 147.8 22.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -170.023 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -73.55 -47.14 43.04 Favored 'General case' 0 CA--C 1.531 0.218 0 O-C-N 121.701 -0.624 . . . . 0.0 109.935 172.055 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.9 p -161.85 146.28 12.76 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -177.661 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.93 158.81 29.2 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 169.807 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.97 -43.63 86.58 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.525 0.73 . . . . 0.0 109.956 174.787 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -167.78 178.03 5.46 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 128.377 2.671 . . . . 0.0 107.452 175.067 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -57.5 -35.6 70.44 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 126.021 1.729 . . . . 0.0 113.734 176.767 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.426 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.4 mt-30 -62.32 -51.18 68.68 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 120.52 1.509 . . . . 0.0 108.308 171.772 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -59.83 -34.26 72.86 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 121.76 -0.587 . . . . 0.0 111.501 179.176 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.87 -32.67 74.49 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.584 -0.698 . . . . 0.0 110.919 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.59 -45.82 81.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 172.113 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -56.72 -42.8 79.83 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 121.624 -0.673 . . . . 0.0 110.569 176.564 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -70.31 -16.37 63.0 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.222 -0.924 . . . . 0.0 112.996 174.209 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m -79.49 -19.11 50.51 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 120.088 1.313 . . . . 0.0 110.916 169.25 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 7.9 mmt -126.36 -17.42 5.16 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 -168.615 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -59.67 -36.15 63.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 120.908 1.685 . . . . 0.0 112.03 -169.37 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.0 m -61.83 -26.81 68.35 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.839 0.745 . . . . 0.0 112.074 179.42 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.8 mt -86.25 -43.83 12.63 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.96 1.304 . . . . 0.0 108.62 177.012 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.7 tp -55.89 -41.93 75.19 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.79 0.836 . . . . 0.0 110.779 177.638 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -60.16 -30.2 69.17 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 126.199 1.8 . . . . 0.0 113.556 -174.694 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.9 mttm -111.54 20.05 17.55 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -177.262 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.341 0.7 OUTLIER 47.47 35.99 4.69 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.403 1.881 . . . . 0.0 114.911 -176.022 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.408 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 49.6 m-85 -64.51 -22.18 66.89 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.258 -0.901 . . . . 0.0 110.112 168.574 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.7 pt -146.12 165.7 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 127.303 2.241 . . . . 0.0 107.569 -177.122 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.4 p -98.5 166.86 11.16 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.3 1.04 . . . . 0.0 108.864 169.292 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -60.72 -31.38 70.67 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.283 -0.886 . . . . 0.0 111.726 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -59.46 -32.86 70.62 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 122.935 0.494 . . . . 0.0 111.626 176.966 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -59.37 -45.97 89.95 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.964 0.505 . . . . 0.0 110.329 -179.203 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.406 ' H ' HD12 ' A' ' 43' ' ' ILE . 4.3 mp -60.01 -49.79 82.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 176.559 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -68.53 -27.24 65.92 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 118.27 -0.872 . . . . 0.0 112.082 -173.636 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.71 -45.0 90.53 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 119.417 1.008 . . . . 0.0 110.557 172.697 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 25.4 mt -68.52 -46.72 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 -178.493 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.7 mttt -59.73 -47.69 84.64 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -177.432 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.13 -44.08 97.43 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 123.85 0.86 . . . . 0.0 110.846 -177.176 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 m -59.74 -48.71 80.59 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.463 0.705 . . . . 0.0 109.942 175.191 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 69.4 m -58.03 -43.49 86.8 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.141 0.976 . . . . 0.0 111.27 178.912 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 73.3 mt -65.89 -41.21 89.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 O-C-N 121.365 -0.834 . . . . 0.0 109.695 177.787 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -72.23 -37.76 69.1 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -172.179 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -141.76 11.08 2.04 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -167.542 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 78.67 170.49 37.86 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 -169.958 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -63.41 153.28 75.59 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 122.964 2.443 . . . . 0.0 111.159 -176.533 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -109.4 -8.54 15.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.66 0.784 . . . . 0.0 112.115 -174.287 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -136.0 77.06 1.64 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.243 1.017 . . . . 0.0 108.729 -169.607 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.8 mm -120.97 135.24 61.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 175.552 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.73 -31.44 4.25 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 122.965 0.506 . . . . 0.0 111.854 -169.517 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.82 164.01 18.46 Favored Pre-proline 0 C--O 1.236 0.368 0 C-N-CA 125.261 1.424 . . . . 0.0 107.532 -177.64 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -45.9 115.2 0.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.306 2.671 . . . . 0.0 111.853 171.284 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.55 1.07 87.88 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-O 117.719 -1.601 . . . . 0.0 114.693 176.199 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 69.9 t -124.93 122.13 62.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 119.966 1.883 . . . . 0.0 108.572 -169.925 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.12 169.76 11.38 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.372 1.469 . . . . 0.0 109.643 176.373 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.59 ' HE2' HD12 ' A' ' 122' ' ' LEU . 4.8 ttm -139.95 59.92 14.26 Favored Pre-proline 0 CA--C 1.537 0.445 0 C-N-CA 123.761 0.824 . . . . 0.0 110.698 174.458 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -57.24 123.85 14.79 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 121.232 1.288 . . . . 0.0 109.83 -174.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -167.08 172.46 10.05 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.129 2.572 . . . . 0.0 108.454 174.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -132.94 171.09 14.42 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.079 1.352 . . . . 0.0 110.24 -174.27 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -57.03 155.36 16.17 Favored Pre-proline 0 N--CA 1.472 0.632 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.602 173.082 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -61.26 -35.67 83.63 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 121.57 1.513 . . . . 0.0 109.361 -176.784 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -67.65 -12.72 61.09 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.971 1.309 . . . . 0.0 112.437 -176.338 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 71.0 m -79.96 -3.3 47.68 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.755 0.707 . . . . 0.0 111.669 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 130.55 19.99 1.28 Allowed Glycine 0 C--N 1.337 0.626 0 CA-C-O 118.33 -1.261 . . . . 0.0 113.343 175.324 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.09 146.12 52.85 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 119.792 1.796 . . . . 0.0 109.041 169.882 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.1 mt -133.71 -28.93 1.37 Allowed 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.776 1.23 . . . . 0.0 111.045 -173.659 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.408 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 87.5 mttt -139.91 174.0 10.95 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.226 1.81 . . . . 0.0 107.749 172.904 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 95.1 m -105.92 126.44 52.18 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.353 1.061 . . . . 0.0 110.613 176.128 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.99 -176.14 41.33 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 125.865 1.698 . . . . 0.0 111.661 -177.597 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 42.1 mtt -146.66 171.3 15.32 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.762 1.625 . . . . 0.0 111.902 -176.77 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.6 m -136.4 161.72 35.05 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.56 1.944 . . . . 0.0 108.469 174.546 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.484 HD22 HD11 ' A' ' 144' ' ' ILE . 30.5 tp -142.52 103.18 4.2 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.21 1.404 . . . . 0.0 108.137 178.508 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 89.7 m -121.76 138.53 54.33 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.97 0.908 . . . . 0.0 108.732 -171.577 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.422 HD23 ' N ' ' A' ' 84' ' ' LEU . 5.1 tt -134.33 133.28 40.51 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 124.214 1.005 . . . . 0.0 108.412 179.095 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.422 ' N ' HD23 ' A' ' 83' ' ' LEU . 8.7 mp -113.51 122.14 46.37 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 126.16 1.784 . . . . 0.0 107.122 179.554 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -60.56 -40.97 93.58 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 118.931 0.787 . . . . 0.0 111.738 -178.727 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -87.54 -20.95 25.75 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 124.371 1.068 . . . . 0.0 111.414 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.5 -177.61 21.0 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 110.591 -1.003 . . . . 0.0 110.591 -168.708 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -148.56 167.54 3.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 169.241 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -120.03 95.99 4.98 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 121.756 -0.59 . . . . 0.0 110.205 -169.794 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -50.2 137.85 20.84 Favored Pre-proline 0 CA--C 1.539 0.527 0 C-N-CA 123.163 0.585 . . . . 0.0 110.392 170.834 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -59.75 130.12 33.73 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 122.89 2.393 . . . . 0.0 110.761 -174.316 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 67.89 9.1 55.7 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 118.158 -1.356 . . . . 0.0 114.665 173.157 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -72.0 168.88 17.11 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 120.169 1.985 . . . . 0.0 109.833 171.877 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.12 -38.68 88.77 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.488 -0.757 . . . . 0.0 111.675 176.907 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -155.64 167.66 13.77 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.546 1.138 . . . . 0.0 111.893 -172.724 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.98 159.7 47.42 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.917 2.411 . . . . 0.0 111.999 178.186 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 36.3 mm -112.99 139.27 39.02 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.357 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -178.266 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -116.94 -7.73 11.36 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 117.835 -1.079 . . . . 0.0 110.743 175.644 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' LEU . . . . . 0.446 HD21 HD13 ' A' ' 131' ' ' LEU . 15.4 tp -145.1 134.08 22.55 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 120.161 1.346 . . . . 0.0 110.712 -176.775 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mp -138.52 111.6 7.9 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 -169.769 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.8 mp -92.84 114.79 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 172.933 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.16 154.02 47.37 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 170.002 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.521 HD23 ' N ' ' A' ' 104' ' ' SER . 0.8 OUTLIER -143.77 150.4 38.51 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 169.741 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.521 ' N ' HD23 ' A' ' 103' ' ' LEU . 27.0 p -144.5 142.29 30.14 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 168.815 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 105' ' ' ALA . . . . . 0.578 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -150.59 132.75 15.35 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 119.395 0.998 . . . . 0.0 108.505 -179.653 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.28 -19.85 57.9 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.818 -174.176 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -140.48 154.59 46.65 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.888 0.875 . . . . 0.0 110.352 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.82 -37.46 76.45 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -178.161 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -71.85 -30.22 65.22 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.966 -1.083 . . . . 0.0 110.83 176.43 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.3 m -65.87 -36.42 83.38 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.437 169.835 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 111' ' ' HIS . . . . . 0.578 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 49.9 m-70 -59.82 -48.87 79.94 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 119.858 1.208 . . . . 0.0 109.476 170.857 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.3 mm -55.34 -54.65 22.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-N 118.703 0.683 . . . . 0.0 109.35 179.518 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.29 -39.25 96.95 Favored Glycine 0 CA--C 1.53 0.997 0 CA-C-N 118.888 0.767 . . . . 0.0 111.692 -176.183 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.428 ' CB ' HD21 ' A' ' 103' ' ' LEU . . . -65.67 -54.97 20.28 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.912 0.885 . . . . 0.0 110.373 179.007 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.6 mm -51.6 -48.24 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 C-N-CA 125.901 1.68 . . . . 0.0 108.424 177.037 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -66.79 -18.01 65.16 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.503 -0.748 . . . . 0.0 111.876 -176.524 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.86 -48.4 8.79 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 123.691 0.796 . . . . 0.0 109.369 173.823 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.426 HD21 HD12 ' A' ' 103' ' ' LEU . 3.2 pp -67.57 -23.56 65.42 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 118.24 0.473 . . . . 0.0 112.131 -178.986 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.426 ' N ' HD12 ' A' ' 118' ' ' LEU . 60.2 m -62.95 -22.91 67.13 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.863 0.865 . . . . 0.0 111.726 174.056 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -66.17 -17.46 64.74 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.945 0.793 . . . . 0.0 110.035 173.505 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 34.8 mt -108.62 -60.94 1.67 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.009 1.324 . . . . 0.0 110.119 179.456 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.59 HD12 ' HE2' ' A' ' 65' ' ' MET . 9.9 mt -62.77 -21.03 65.55 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.877 1.436 . . . . 0.0 114.877 -175.604 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 38.1 m -111.13 26.15 11.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.945 0.793 . . . . 0.0 110.826 -179.201 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -132.51 97.38 4.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.064 1.346 . . . . 0.0 107.74 178.409 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.06 -27.8 54.92 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.691 0.797 . . . . 0.0 112.456 -177.128 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -65.12 -44.55 88.34 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 123.163 0.585 . . . . 0.0 110.02 176.584 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.92 -43.31 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 174.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.474 HD21 ' HA ' ' A' ' 122' ' ' LEU . 55.8 mt -55.66 -43.5 76.35 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 118.58 0.627 . . . . 0.0 111.128 -174.532 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -67.37 -38.85 85.41 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.775 0.43 . . . . 0.0 110.614 178.797 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -70.03 -33.23 71.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 118.663 0.665 . . . . 0.0 109.91 -176.967 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.446 HD13 HD21 ' A' ' 99' ' ' LEU . 32.4 mt -68.3 -56.31 9.05 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 169.834 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 40.3 mt -57.64 -12.12 2.63 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 -174.395 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 50.9 p -114.11 7.45 16.69 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.067 1.347 . . . . 0.0 111.433 179.358 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.48 110.86 1.2 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.499 1.519 . . . . 0.0 110.235 175.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.6 m -68.25 -28.02 66.85 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.099 0.559 . . . . 0.0 111.838 176.846 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.2 m -149.54 160.53 43.4 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.056 1.343 . . . . 0.0 108.917 -172.183 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 57.2 mp0 -54.24 -34.47 60.79 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.119 1.367 . . . . 0.0 111.408 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -53.22 -38.27 62.77 Favored 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 123.119 0.568 . . . . 0.0 112.442 -179.893 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -80.75 -27.7 36.72 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 119.024 0.829 . . . . 0.0 110.605 -178.234 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.9 mt -65.48 -50.5 65.11 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.434 1.015 . . . . 0.0 108.303 171.466 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.72 -33.94 73.66 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.123 0.969 . . . . 0.0 112.679 176.811 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -59.83 -43.45 94.56 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 118.955 0.798 . . . . 0.0 110.677 175.185 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 77.4 mt -70.5 -35.12 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 123.166 0.586 . . . . 0.0 109.716 -178.57 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 144' ' ' ILE . . . . . 0.484 HD11 HD22 ' A' ' 81' ' ' LEU . 22.3 mm -57.17 -52.37 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 169.469 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 21.4 m -65.1 -27.83 69.03 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.279 -170.808 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -59.3 -24.55 63.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.275 1.83 . . . . 0.0 113.601 174.565 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.931 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 -176.966 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.484 1.249 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -58.71 121.09 10.2 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 169.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.79 -45.42 78.48 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.7 m -52.91 -28.03 21.45 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.29 1.436 . . . . 0.0 113.701 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -58.15 -27.53 63.88 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.771 0.829 . . . . 0.0 112.343 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -92.68 -7.26 47.3 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.886 0.875 . . . . 0.0 112.851 -177.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -108.7 106.01 57.99 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 119.967 1.258 . . . . 0.0 108.568 -171.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.87 -62.22 0.12 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.598 2.199 . . . . 0.0 113.299 -173.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -174.33 -65.93 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.67 1.188 . . . . 0.0 109.182 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.1 m -73.26 2.97 6.37 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.229 1.411 . . . . 0.0 112.604 -176.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.19 -4.01 15.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 128.436 2.694 . . . . 0.0 114.289 -169.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 21.0 mt -126.55 127.12 70.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 120.332 1.423 . . . . 0.0 108.188 -168.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.9 m -143.36 145.92 33.09 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.292 1.037 . . . . 0.0 111.308 -171.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.9 t -123.85 135.69 62.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 165.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 55.9 mt -138.7 143.06 33.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 -168.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 44.4 t60 -68.18 -49.25 62.11 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.812 -0.555 . . . . 0.0 110.037 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -160.07 145.11 14.98 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.628 1.571 . . . . 0.0 107.088 171.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.5 150.37 47.24 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 167.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -60.49 -40.64 92.05 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.578 0.351 . . . . 0.0 110.832 178.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -161.46 178.25 9.31 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.248 1.419 . . . . 0.0 108.886 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -32.94 63.51 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.915 0.886 . . . . 0.0 113.057 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -76.83 -42.67 39.41 Favored 'General case' 0 C--N 1.339 0.13 0 CA-C-N 119.842 1.201 . . . . 0.0 109.499 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -64.81 -29.06 70.0 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.976 0.353 . . . . 0.0 110.602 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.73 98.25 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.373 -0.83 . . . . 0.0 111.313 173.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.7 mt -67.0 -43.52 89.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -59.14 -47.21 86.13 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.403 0.547 . . . . 0.0 111.081 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -66.19 -20.89 66.27 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.069 0.85 . . . . 0.0 112.844 176.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.9 m -79.47 -8.24 58.99 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.223 0.919 . . . . 0.0 112.181 172.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.2 mmt -131.31 -24.74 2.27 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.9 0.88 . . . . 0.0 112.731 -166.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -58.99 -36.91 64.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 119.216 0.917 . . . . 0.0 111.383 -171.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -66.54 -24.48 66.38 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.61 -0.682 . . . . 0.0 112.819 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.2 mt -85.22 -41.23 15.8 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.871 0.869 . . . . 0.0 109.118 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.0 tp -58.81 -40.29 83.68 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.096 0.958 . . . . 0.0 110.61 175.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -62.5 -26.19 68.41 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.731 1.213 . . . . 0.0 112.935 -176.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -108.08 14.73 24.89 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.367 0.667 . . . . 0.0 110.738 176.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.254 10.8 p30 45.24 41.97 6.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.361 1.865 . . . . 0.0 113.698 -172.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -64.06 -22.29 66.87 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.973 -1.079 . . . . 0.0 110.766 159.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.6 pt -143.45 163.5 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 126.301 1.84 . . . . 0.0 109.011 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.1 m -97.56 163.73 12.73 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.979 1.712 . . . . 0.0 109.274 166.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -57.51 -35.47 70.3 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.598 0.759 . . . . 0.0 112.318 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -58.9 -30.65 67.96 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.143 0.577 . . . . 0.0 112.206 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.74 -45.06 93.36 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.166 0.587 . . . . 0.0 110.244 -179.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.457 ' H ' HD12 ' A' ' 43' ' ' ILE . 4.5 mp -64.1 -47.31 90.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -64.73 -31.02 72.06 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.62 -0.705 . . . . 0.0 111.567 -174.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.55 -42.24 96.18 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.211 0.914 . . . . 0.0 111.16 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 19.1 mt -67.11 -46.27 84.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.45 -49.31 77.77 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.248 0.476 . . . . 0.0 110.079 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.93 -41.65 99.55 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 123.234 0.614 . . . . 0.0 111.011 -177.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 28.0 m -64.68 -40.93 96.25 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.692 0.397 . . . . 0.0 111.228 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 89.5 m . . . . . 0 N--CA 1.452 -0.349 0 C-N-CA 123.866 0.866 . . . . 0.0 109.784 178.035 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 . . . . . 0 C--O 1.232 0.173 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.5 mm -112.62 131.1 65.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 104.945 -2.242 . . . . 0.0 104.945 169.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -116.71 -27.17 6.74 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 122.784 0.434 . . . . 0.0 111.464 -168.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.05 161.39 29.58 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 125.53 1.532 . . . . 0.0 107.158 174.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -47.91 115.63 1.57 Allowed 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.11 2.54 . . . . 0.0 111.085 170.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.52 3.66 71.43 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 117.928 -1.484 . . . . 0.0 114.508 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.1 t -129.95 127.25 63.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 119.781 1.79 . . . . 0.0 109.563 -169.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.29 168.8 17.91 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.069 1.347 . . . . 0.0 110.915 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.2 ttm -140.99 73.26 27.18 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 123.622 0.769 . . . . 0.0 110.947 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -50.38 122.68 9.85 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.991 2.46 . . . . 0.0 112.774 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -163.39 155.06 17.28 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.176 1.791 . . . . 0.0 107.471 -175.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.61 165.86 25.82 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.329 1.452 . . . . 0.0 108.077 171.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -60.63 153.25 63.23 Favored Pre-proline 0 N--CA 1.469 0.523 0 O-C-N 121.272 -0.892 . . . . 0.0 109.876 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -46.9 -46.75 17.86 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.218 2.612 . . . . 0.0 113.048 176.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -66.99 -11.05 55.79 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.601 1.16 . . . . 0.0 113.867 -177.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 80.8 m -74.39 -11.59 60.29 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.646 1.112 . . . . 0.0 112.355 172.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 136.42 24.23 0.5 Allowed Glycine 0 CA--C 1.526 0.735 0 CA-C-O 118.71 -1.05 . . . . 0.0 113.86 171.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.32 155.39 38.24 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 119.547 1.674 . . . . 0.0 109.069 168.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.8 mt -132.86 -25.78 1.82 Allowed 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.796 1.239 . . . . 0.0 111.063 -174.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -145.88 -168.72 3.06 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.652 1.981 . . . . 0.0 106.85 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 41.0 m -125.45 126.79 45.48 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.363 0.665 . . . . 0.0 109.582 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.37 -176.23 40.98 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.046 0.831 . . . . 0.0 111.73 -176.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 62.1 mtt -143.71 168.47 19.82 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.562 1.545 . . . . 0.0 111.401 -176.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.3 m -138.21 168.7 19.18 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.385 1.874 . . . . 0.0 108.478 171.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.4 tp -151.45 120.84 6.84 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.95 1.7 . . . . 0.0 107.425 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 42.4 m -136.17 129.02 31.07 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.8 tp -117.56 136.67 53.11 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 175.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.3 mp -115.48 116.15 27.72 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -59.41 -39.88 84.87 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.637 0.653 . . . . 0.0 111.621 -175.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -102.36 -2.31 29.16 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.38 0.672 . . . . 0.0 112.309 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 65.85 -175.05 18.5 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.198 0.904 . . . . 0.0 113.674 -176.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -150.59 149.03 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 167.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -86.67 119.27 26.73 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 . . . . . 0 CA--C 1.535 0.395 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 172.508 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo . . . . . 0 N--CA 1.457 -0.646 0 CA-C-O 121.657 0.607 . . . . 0.0 111.783 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 48.4 mm -88.39 135.73 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 177.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -109.86 -25.04 10.53 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.742 0.817 . . . . 0.0 111.487 172.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 55.4 tp -127.98 126.51 41.51 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -169.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mp -133.28 139.27 46.82 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 -178.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.472 HD12 HD21 ' A' ' 122' ' ' LEU . 4.7 mt -125.49 123.62 65.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 173.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.99 155.48 36.75 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 176.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -149.99 138.73 20.85 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 176.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 54.3 p -139.11 155.45 47.88 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.107 1.363 . . . . 0.0 108.815 164.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.57 140.79 22.22 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.485 0.714 . . . . 0.0 109.634 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.23 -16.99 59.71 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 179.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -154.4 154.81 33.89 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.645 1.178 . . . . 0.0 109.221 -173.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.46 -35.36 73.92 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.62 0.768 . . . . 0.0 112.79 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.52 -38.55 74.28 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 119.474 1.034 . . . . 0.0 110.429 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.1 m -63.55 -38.23 90.36 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.172 0.589 . . . . 0.0 110.31 173.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -59.45 -49.23 78.62 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.096 172.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.4 mm -58.97 -46.08 91.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 119.557 1.072 . . . . 0.0 109.876 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.06 -46.64 93.45 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-N 118.846 0.748 . . . . 0.0 111.342 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.08 -46.36 89.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.419 0.688 . . . . 0.0 111.232 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.3 mm -56.62 -51.95 59.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -59.14 -33.87 71.39 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 118.782 -0.628 . . . . 0.0 111.419 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -64.92 -56.31 14.08 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.764 0.711 . . . . 0.0 110.489 173.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . 0.275 1.4 pp -71.3 -17.41 62.46 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 -174.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.5 m -60.07 -27.28 66.84 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 120.155 1.343 . . . . 0.0 111.607 170.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.08 -12.29 49.08 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.026 0.83 . . . . 0.0 111.801 175.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 69.6 mt -111.78 -51.52 2.85 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.397 1.079 . . . . 0.0 109.428 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.472 HD21 HD12 ' A' ' 101' ' ' ILE . 13.6 mt -73.45 -19.95 60.83 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -170.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.4 m -108.95 21.02 17.76 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.92 0.888 . . . . 0.0 110.758 -177.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -128.04 100.04 5.72 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.44 -28.62 63.49 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.687 0.795 . . . . 0.0 112.599 -175.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.31 -39.17 93.37 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.137 0.575 . . . . 0.0 110.386 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.71 -40.29 47.07 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.1 mt -57.7 -43.94 85.54 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.997 0.817 . . . . 0.0 110.615 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -57.83 -51.45 69.54 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.457 0.571 . . . . 0.0 110.05 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -65.05 -33.35 75.83 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.732 0.413 . . . . 0.0 112.087 -175.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 63.3 mt -68.06 -47.37 68.51 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 173.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.0 mt -64.22 -34.87 79.08 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 118.891 -0.576 . . . . 0.0 111.743 -176.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 63.8 p -87.49 -0.66 57.15 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.088 0.858 . . . . 0.0 112.343 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.42 118.19 5.3 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.368 0.985 . . . . 0.0 111.23 -171.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.6 m -73.05 -20.17 61.03 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.174 0.59 . . . . 0.0 112.272 -177.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.5 p -155.68 164.65 38.32 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.592 0.71 . . . . 0.0 110.832 -170.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.09 -30.94 66.64 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.786 0.834 . . . . 0.0 110.528 170.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.0 tptt -64.61 -44.01 91.94 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.47 0.577 . . . . 0.0 110.53 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -67.55 -37.95 83.43 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.258 0.481 . . . . 0.0 110.225 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 56.0 mt -60.59 -45.85 92.43 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.331 0.514 . . . . 0.0 110.357 173.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.81 92.63 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.562 0.745 . . . . 0.0 111.637 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -56.52 -42.45 78.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.759 0.709 . . . . 0.0 110.995 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 70.9 mt -66.78 -35.02 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 122.98 0.512 . . . . 0.0 109.782 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 26.4 mm -64.68 -49.55 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 119.143 0.883 . . . . 0.0 109.316 172.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 38.4 m -59.03 -30.54 68.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.102 0.865 . . . . 0.0 112.392 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -65.93 -22.1 66.47 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.272 1.029 . . . . 0.0 112.415 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.945 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 -178.845 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 tpt . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.738 0.304 . . . . 0.0 110.946 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -68.99 109.48 3.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 169.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.18 -44.29 83.43 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.351 1.06 . . . . 0.0 109.81 -172.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.07 -23.43 20.22 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.723 1.209 . . . . 0.0 112.682 -175.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -58.94 -28.41 66.23 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.776 0.716 . . . . 0.0 111.981 176.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -92.48 -13.29 30.13 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 117.911 -1.043 . . . . 0.0 112.66 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -112.67 85.33 7.36 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 120.974 1.715 . . . . 0.0 107.215 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.58 -59.52 1.16 Allowed 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 123.724 2.949 . . . . 0.0 115.464 -169.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.483 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.8 tp10 -161.62 -77.02 0.05 Allowed 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 118.677 0.672 . . . . 0.0 112.271 -178.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -68.61 13.62 0.09 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.109 1.764 . . . . 0.0 111.843 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 9' ' ' GLU . 5.5 m -75.65 8.7 2.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 128.508 2.723 . . . . 0.0 113.452 -168.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.4 mm -135.82 134.73 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 104.491 -2.411 . . . . 0.0 104.491 -169.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 75.7 m -155.33 147.31 23.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 118.83 0.741 . . . . 0.0 110.454 174.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 77.4 t -124.06 136.19 61.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 103.866 -2.642 . . . . 0.0 103.866 169.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 37.6 mt -139.0 147.86 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 N-CA-C 105.159 -2.163 . . . . 0.0 105.159 -169.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -66.87 -42.69 85.19 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.389 -0.819 . . . . 0.0 110.714 175.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -167.4 145.7 4.81 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.41 155.19 36.63 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -60.26 -40.12 89.21 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 176.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -167.84 -177.06 3.29 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 128.019 2.528 . . . . 0.0 107.521 172.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -61.76 -33.78 74.69 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 177.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.484 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.7 mt-30 -59.75 -51.48 69.58 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.621 1.555 . . . . 0.0 107.433 172.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -60.57 -34.55 74.35 Favored 'General case' 0 C--O 1.223 -0.337 0 O-C-N 121.646 -0.659 . . . . 0.0 111.521 177.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.5 73.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.629 -0.67 . . . . 0.0 110.883 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.94 -47.47 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 171.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.68 -45.45 81.74 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.743 -0.598 . . . . 0.0 110.557 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -68.57 -17.46 64.14 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 118.048 -0.977 . . . . 0.0 112.64 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.9 m -80.25 -17.61 51.74 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 120.866 1.666 . . . . 0.0 111.87 169.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.8 mmt -125.0 -18.44 5.49 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -169.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.4 -36.23 62.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-N 120.437 1.471 . . . . 0.0 111.734 -169.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.8 m -63.15 -22.34 66.8 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.757 0.708 . . . . 0.0 112.269 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 80.7 mt -89.91 -41.68 11.65 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.24 1.016 . . . . 0.0 109.125 174.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -55.36 -42.15 73.52 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.61 0.764 . . . . 0.0 110.576 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.75 -24.26 66.19 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 125.816 1.646 . . . . 0.0 114.102 -171.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -111.01 21.96 15.84 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.029 0.377 . . . . 0.0 110.422 172.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 54.84 34.19 21.46 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.996 1.318 . . . . 0.0 113.166 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -68.37 -22.12 64.68 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 120.583 -1.323 . . . . 0.0 109.71 168.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.1 pt -142.2 174.69 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 126.74 2.016 . . . . 0.0 108.557 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 m -112.24 159.9 18.15 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 126.471 1.908 . . . . 0.0 107.813 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.2 -31.22 69.95 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.24 -0.913 . . . . 0.0 112.337 -174.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -58.09 -32.48 68.11 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.052 0.541 . . . . 0.0 112.004 175.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -61.13 -44.13 97.81 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.358 0.663 . . . . 0.0 110.48 -177.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.406 ' H ' HD12 ' A' ' 43' ' ' ILE . 4.2 mp -59.17 -50.13 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 174.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 36.9 tp60 -69.37 -25.01 63.96 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.437 -0.792 . . . . 0.0 112.142 -175.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.56 98.99 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 119.699 1.136 . . . . 0.0 110.627 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.0 mt -68.4 -45.53 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.484 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.3 mttt -60.73 -41.08 94.61 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.382 0.537 . . . . 0.0 110.096 -178.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -65.15 -38.76 91.62 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.892 0.877 . . . . 0.0 111.41 177.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -63.05 -36.7 84.44 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.652 -0.655 . . . . 0.0 110.376 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.6 m . . . . . 0 CA--C 1.54 0.583 0 C-N-CA 124.04 0.936 . . . . 0.0 110.664 176.315 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 . . . . . 0 N--CA 1.449 -0.498 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.2 mm -138.59 140.88 38.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mp -132.58 -27.91 1.68 Allowed 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -169.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.2 160.88 24.22 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.77 114.42 1.36 Allowed 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.728 2.285 . . . . 0.0 111.15 174.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.39 12.5 72.85 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 118.137 -1.368 . . . . 0.0 114.19 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.86 127.15 63.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-N 119.722 1.761 . . . . 0.0 108.827 -174.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.71 169.46 12.52 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.61 1.564 . . . . 0.0 109.809 179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.418 ' CE ' HD13 ' A' ' 118' ' ' LEU . 14.5 ttm -143.51 67.98 16.69 Favored Pre-proline 0 CA--C 1.536 0.436 0 O-C-N 121.926 -0.484 . . . . 0.0 111.295 176.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.06 149.4 53.27 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 121.297 1.331 . . . . 0.0 113.066 -174.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 174.15 153.44 0.11 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 128.582 2.753 . . . . 0.0 106.28 -169.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.85 166.1 24.09 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 125.988 1.715 . . . . 0.0 106.903 172.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -52.71 147.86 14.36 Favored Pre-proline 0 CA--C 1.536 0.421 0 CA-C-O 118.526 -0.749 . . . . 0.0 109.352 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -47.44 -42.13 28.65 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.794 2.33 . . . . 0.0 112.281 174.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -62.77 -13.8 37.37 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.491 1.116 . . . . 0.0 113.712 -177.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 71.6 m -78.28 -0.68 29.69 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.857 0.753 . . . . 0.0 111.827 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.54 15.03 2.26 Favored Glycine 0 C--N 1.336 0.53 0 CA-C-O 118.32 -1.267 . . . . 0.0 112.929 171.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.33 147.96 52.54 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 119.42 1.61 . . . . 0.0 109.549 169.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.1 mt -131.32 -33.5 1.48 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.519 1.128 . . . . 0.0 110.402 -174.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -145.5 156.69 43.87 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.516 1.527 . . . . 0.0 108.104 177.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.9 m -90.14 132.68 35.32 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 122.984 0.514 . . . . 0.0 110.365 -176.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.01 -176.17 43.08 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.739 1.161 . . . . 0.0 110.8 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 46.9 mtt -148.9 170.87 17.32 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.552 1.941 . . . . 0.0 110.284 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.42 162.67 40.12 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.085 1.754 . . . . 0.0 108.339 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.1 tp -146.42 122.45 10.74 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 126.207 1.803 . . . . 0.0 108.338 -172.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 74.2 m -137.25 143.79 42.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.373 1.069 . . . . 0.0 108.522 -171.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.2 tt -141.81 131.65 24.35 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 177.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -107.25 118.08 35.77 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 126.769 2.027 . . . . 0.0 107.018 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -59.49 -34.73 72.94 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.985 0.812 . . . . 0.0 112.45 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -96.67 -10.6 26.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.03 0.932 . . . . 0.0 112.097 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.73 179.97 11.88 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -169.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -149.23 161.38 5.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 169.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -109.02 118.02 35.72 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -169.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 . . . . . 0 CA--C 1.541 0.603 0 C-N-CA 123.798 0.839 . . . . 0.0 109.65 174.26 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 N--CA 1.455 -0.779 0 N-CA-C 110.204 -0.729 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 30.6 mm -85.9 135.43 25.01 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -110.04 -16.35 13.83 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.379 -1.296 . . . . 0.0 111.069 172.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 40.7 tp -147.79 135.04 20.53 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 120.409 1.459 . . . . 0.0 110.429 -169.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.7 mp -138.99 136.99 35.96 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.307 1.043 . . . . 0.0 109.061 -172.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 4.0 mt -116.72 115.42 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.051 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 168.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.81 152.52 40.83 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 171.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.494 HD23 ' N ' ' A' ' 104' ' ' SER . 0.5 OUTLIER -144.32 137.83 27.45 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 104.856 -2.276 . . . . 0.0 104.856 169.703 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.494 ' N ' HD23 ' A' ' 103' ' ' LEU . 92.1 p -129.99 148.03 51.8 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.047 1.739 . . . . 0.0 107.412 169.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.84 136.6 23.13 Favored 'General case' 0 CA--C 1.513 -0.474 0 O-C-N 121.625 -0.672 . . . . 0.0 109.671 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.22 -21.35 60.66 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 123.525 0.515 . . . . 0.0 111.628 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -143.92 153.0 41.84 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.863 0.865 . . . . 0.0 109.738 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.43 -33.37 71.17 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -77.61 -31.04 52.64 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.306 0.957 . . . . 0.0 111.236 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.5 m -63.53 -37.99 89.42 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.901 -0.499 . . . . 0.0 109.701 169.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -47.7 84.37 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.191 0.996 . . . . 0.0 110.219 171.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.0 mm -58.38 -50.62 78.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.03 -39.2 93.99 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-N 119.115 0.871 . . . . 0.0 111.93 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.12 -52.66 32.31 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.567 1.147 . . . . 0.0 110.567 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.0 mm -50.81 -47.34 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 125.508 1.523 . . . . 0.0 108.671 173.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -66.55 -9.45 35.1 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.974 -1.079 . . . . 0.0 112.542 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -93.87 -48.5 6.25 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 124.204 1.002 . . . . 0.0 109.626 169.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.548 HD12 ' N ' ' A' ' 119' ' ' SER . 1.1 pp -72.39 -24.38 61.24 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 113.313 0.856 . . . . 0.0 113.313 -173.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . 0.548 ' N ' HD12 ' A' ' 118' ' ' LEU . 10.3 p -66.11 -21.69 66.36 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 123.124 0.57 . . . . 0.0 111.457 172.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -67.0 -21.25 65.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.246 0.93 . . . . 0.0 109.849 172.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 24.8 mt -96.82 -71.21 0.69 Allowed 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.12 0.968 . . . . 0.0 110.783 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 20.0 mt -69.06 -13.33 62.38 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 -169.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 31.2 m -100.22 27.26 5.77 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 120.243 1.383 . . . . 0.0 111.522 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -128.88 110.46 12.14 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.625 1.97 . . . . 0.0 106.104 172.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -60.24 -26.63 66.59 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.863 0.465 . . . . 0.0 111.453 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -62.93 -47.49 82.99 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 123.619 0.768 . . . . 0.0 109.676 175.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -65.52 -44.16 94.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 123.982 0.913 . . . . 0.0 109.092 176.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 48.2 mt -56.12 -43.39 78.12 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 118.632 0.651 . . . . 0.0 111.487 -175.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -67.74 -40.47 84.15 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 118.052 0.387 . . . . 0.0 110.462 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.424 ' HB3' HD11 ' A' ' 143' ' ' ILE . 44.0 mt-30 -69.64 -33.08 72.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 118.749 0.704 . . . . 0.0 110.214 -176.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 19.1 mt -68.3 -56.77 7.43 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 170.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 35.7 mt -55.41 -26.22 40.47 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -173.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 74.4 p -101.57 6.78 42.31 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.402 1.081 . . . . 0.0 112.338 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.31 112.7 1.65 Allowed 'General case' 0 C--N 1.342 0.264 0 C-N-CA 124.845 1.258 . . . . 0.0 110.493 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 7.4 m -70.0 -24.81 63.36 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.253 0.621 . . . . 0.0 112.054 177.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 15.5 m -150.59 158.97 44.77 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.111 0.964 . . . . 0.0 110.16 -169.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -51.15 -39.34 56.08 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.949 1.7 . . . . 0.0 111.1 176.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -57.25 -35.36 69.63 Favored 'General case' 0 C--O 1.227 -0.103 0 C-N-CA 123.13 0.572 . . . . 0.0 112.384 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -80.44 -27.71 37.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 119.426 1.012 . . . . 0.0 110.413 -177.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 27.4 mt -66.15 -50.44 63.93 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.526 1.057 . . . . 0.0 108.387 170.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.12 -33.75 67.68 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.934 0.894 . . . . 0.0 113.15 174.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.76 -42.53 99.73 Favored 'General case' 0 N--CA 1.463 0.177 0 O-C-N 121.209 -0.932 . . . . 0.0 110.868 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.424 HD11 ' HB3' ' A' ' 130' ' ' GLN . 96.6 mt -69.15 -35.41 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.1 mm -58.26 -53.82 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 169.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 24.7 m -63.96 -27.0 68.84 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 122.68 0.392 . . . . 0.0 111.578 -170.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -59.82 -27.38 66.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.663 1.585 . . . . 0.0 113.404 175.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.851 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 -174.64 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.486 1.354 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -67.05 112.39 4.36 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 104.873 -2.269 . . . . 0.0 104.873 168.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -48.53 -43.51 35.43 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.983 0.913 . . . . 0.0 110.377 -176.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.42 -24.36 1.94 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.685 1.994 . . . . 0.0 113.902 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -59.42 -26.85 65.51 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.291 0.951 . . . . 0.0 112.337 177.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -100.44 -15.86 17.77 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.098 0.959 . . . . 0.0 112.902 -174.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -103.09 98.32 11.52 Favored Pre-proline 0 N--CA 1.471 0.624 0 CA-C-N 120.879 1.672 . . . . 0.0 106.985 -173.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.5 -60.43 0.31 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.696 2.264 . . . . 0.0 113.434 -171.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.408 ' C ' ' H ' ' A' ' 11' ' ' SER . 54.9 tt0 -165.97 -87.02 0.02 OUTLIER 'General case' 0 C--O 1.232 0.157 0 C-N-CA 123.592 0.757 . . . . 0.0 111.621 -170.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.2 m -67.87 8.76 0.35 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.337 1.455 . . . . 0.0 111.754 176.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.408 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -65.63 -25.54 67.42 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.99 1.316 . . . . 0.0 111.905 -174.926 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.2 mp -98.23 140.0 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.975 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.0 m -154.39 158.36 39.91 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.483 0.659 . . . . 0.0 110.606 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.5 t -128.33 145.46 35.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 173.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mm -138.76 140.04 39.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 104.654 -2.351 . . . . 0.0 104.654 -169.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -71.34 -49.52 41.63 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 119.269 0.941 . . . . 0.0 109.303 171.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.0 p -159.4 144.24 15.48 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.5 156.87 25.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 169.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.7 ttpt -58.75 -42.07 87.99 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.878 0.471 . . . . 0.0 110.653 175.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -165.22 177.69 7.46 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 128.212 2.605 . . . . 0.0 107.214 173.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.81 -37.07 65.65 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.227 1.811 . . . . 0.0 114.036 175.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.403 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.6 mt-30 -62.6 -50.35 71.6 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 120.401 1.455 . . . . 0.0 108.687 173.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -60.55 -32.45 71.52 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 122.951 0.5 . . . . 0.0 111.416 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.36 -37.86 86.27 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 121.575 -0.703 . . . . 0.0 110.158 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.51 -47.28 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 170.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -58.03 -49.64 76.15 Favored 'General case' 0 C--N 1.334 -0.082 0 C-N-CA 123.222 0.609 . . . . 0.0 110.657 -174.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -62.82 -28.69 70.18 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.568 1.147 . . . . 0.0 111.626 174.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.2 m -76.51 -15.18 59.94 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.718 1.145 . . . . 0.0 112.766 177.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.94 -12.49 4.7 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -171.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -55.75 -34.19 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 120.525 1.511 . . . . 0.0 112.069 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.9 m -66.84 -41.61 87.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.385 -0.822 . . . . 0.0 110.253 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -65.74 -38.45 89.15 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 46.2 tp -60.65 -49.86 75.82 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.534 0.734 . . . . 0.0 110.316 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -64.92 -33.2 75.45 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.398 1.079 . . . . 0.0 112.221 -176.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -79.86 -0.37 34.47 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.654 1.182 . . . . 0.0 111.876 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 53.82 32.07 14.29 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.24 1.816 . . . . 0.0 113.284 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -68.31 -24.88 64.89 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 120.819 -1.175 . . . . 0.0 109.709 168.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.6 pt -144.07 168.72 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 126.235 1.814 . . . . 0.0 110.016 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.3 p -96.11 172.56 7.91 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.807 1.243 . . . . 0.0 109.845 169.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.27 -33.05 74.49 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.267 -0.896 . . . . 0.0 110.557 171.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -61.27 -40.25 93.41 Favored 'General case' 0 C--N 1.342 0.251 0 O-C-N 121.97 -0.456 . . . . 0.0 110.684 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -54.28 -49.48 69.49 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.009 0.524 . . . . 0.0 110.154 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 45.2 mt -59.72 -49.2 84.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 C-N-CA 123.644 0.778 . . . . 0.0 109.246 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -68.5 -26.87 65.68 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.165 -0.921 . . . . 0.0 111.995 -174.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.95 83.29 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.566 1.076 . . . . 0.0 110.683 171.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.06 -51.72 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.403 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.9 mttt -58.52 -44.03 89.36 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -175.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -64.28 -46.24 84.54 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.774 0.83 . . . . 0.0 111.275 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.0 m -64.05 -35.79 81.88 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.801 0.44 . . . . 0.0 110.76 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 96.8 m . . . . . 0 N--CA 1.449 -0.495 0 C-N-CA 123.746 0.818 . . . . 0.0 109.827 177.891 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 . . . . . 0 N--CA 1.452 -0.328 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 26.3 mm -137.04 140.03 43.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 102.643 -3.095 . . . . 0.0 102.643 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.586 HD12 HG12 ' A' ' 63' ' ' VAL . 30.7 mt -110.39 -40.46 4.64 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -168.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -168.38 165.03 7.82 Favored Pre-proline 0 C--O 1.236 0.384 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -169.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -47.92 113.03 0.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.827 2.351 . . . . 0.0 110.756 169.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.16 5.78 75.99 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 117.81 -1.55 . . . . 0.0 114.848 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.586 HG12 HD12 ' A' ' 59' ' ' LEU . 19.0 t -135.3 133.95 52.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-N 120.92 2.36 . . . . 0.0 109.524 -171.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.65 166.77 21.84 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.786 1.635 . . . . 0.0 110.281 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.525 ' HB2' HD11 ' A' ' 59' ' ' LEU . 33.5 ttp -147.5 82.44 8.13 Favored Pre-proline 0 C--O 1.225 -0.195 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 170.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -58.76 -91.21 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.312 0 C-N-CA 123.036 2.491 . . . . 0.0 114.43 -174.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . 0.301 0.2 OUTLIER 47.78 178.18 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.578 2.351 . . . . 0.0 114.753 -168.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.7 167.94 19.92 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 125.281 1.432 . . . . 0.0 107.848 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 25.1 mtm105 -60.74 150.57 75.61 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-O 118.575 -0.726 . . . . 0.0 109.046 174.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -45.63 -45.14 16.73 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.634 2.889 . . . . 0.0 112.755 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -61.71 -15.55 41.48 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.219 1.408 . . . . 0.0 113.643 -176.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.5 m -79.63 -4.72 52.91 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.518 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 131.49 18.64 1.27 Allowed Glycine 0 CA--C 1.523 0.579 0 CA-C-O 118.943 -0.92 . . . . 0.0 113.591 174.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.0 144.2 56.34 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 119.087 1.443 . . . . 0.0 107.645 169.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.9 mt -123.69 -32.63 3.3 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 124.313 1.045 . . . . 0.0 110.158 -173.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -143.19 170.85 14.97 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.415 1.886 . . . . 0.0 107.468 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 97.5 m -103.17 122.23 44.28 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.464 0.706 . . . . 0.0 110.381 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.11 -177.23 38.65 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 126.017 1.77 . . . . 0.0 111.052 -175.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.607 ' SD ' HD21 ' A' ' 118' ' ' LEU . 51.4 mtt -149.15 169.83 19.82 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.594 1.697 . . . . 0.0 112.065 -171.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.9 p -146.86 168.08 22.32 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.859 1.264 . . . . 0.0 109.793 174.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.555 HD22 HD11 ' A' ' 144' ' ' ILE . 24.5 tp -153.98 106.78 2.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.797 1.639 . . . . 0.0 106.795 -172.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 65.5 m -122.7 140.9 52.36 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 123.79 0.836 . . . . 0.0 108.77 -169.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.4 tt -133.67 130.47 38.26 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.3 mp -110.32 119.45 39.28 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.744 1.617 . . . . 0.0 107.924 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -63.1 -36.15 82.62 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.588 0.631 . . . . 0.0 112.178 -177.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -91.05 -17.1 26.79 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.811 1.245 . . . . 0.0 111.919 177.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 68.1 -179.93 18.18 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -168.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.74 162.94 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 169.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -121.09 83.82 2.14 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 122.295 1.045 . . . . 0.0 110.605 -169.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 . . . . . 0 CA--C 1.538 0.507 0 CA-C-N 114.317 -1.31 . . . . 0.0 112.212 174.142 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo . . . . . 0 N--CA 1.456 -0.715 0 CA-C-O 121.546 0.561 . . . . 0.0 112.593 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 47.5 mm -112.43 136.95 47.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 C-N-CA 124.735 1.214 . . . . 0.0 107.876 -171.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -113.74 -9.71 13.12 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 117.192 -1.385 . . . . 0.0 110.973 175.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.9 mt -136.37 138.94 42.12 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 120.582 1.537 . . . . 0.0 111.309 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.5 mp -137.02 101.46 4.57 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.428 HG21 HD22 ' A' ' 118' ' ' LEU . 1.7 mp -77.05 146.43 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 169.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.06 23.68 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 109.035 -1.626 . . . . 0.0 109.035 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.519 HD23 ' N ' ' A' ' 104' ' ' SER . 1.1 tt -155.04 150.0 26.79 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 -171.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.519 ' N ' HD23 ' A' ' 103' ' ' LEU . 11.0 p -143.0 141.95 31.48 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 127.226 2.211 . . . . 0.0 105.084 169.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -149.23 130.22 14.37 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -173.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.29 -22.96 57.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 123.399 0.437 . . . . 0.0 111.428 -175.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -139.41 155.76 47.42 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.778 0.831 . . . . 0.0 110.32 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.87 -34.24 71.4 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.684 0.793 . . . . 0.0 112.973 -177.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -77.28 -32.16 55.34 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.1 0.864 . . . . 0.0 111.102 177.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.3 m -60.48 -41.7 94.78 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 169.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.36 -47.3 84.24 Favored 'General case' 0 C--O 1.225 -0.21 0 C-N-CA 124.68 1.192 . . . . 0.0 110.71 173.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 15.1 mm -59.69 -53.03 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -63.14 -37.04 94.27 Favored Glycine 0 CA--C 1.528 0.891 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 -177.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.432 ' CB ' HD21 ' A' ' 103' ' ' LEU . . . -66.0 -50.77 63.11 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.641 1.177 . . . . 0.0 110.53 177.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 mm -54.71 -45.54 73.19 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.28 -10.32 59.56 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.674 0.79 . . . . 0.0 113.056 -177.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.23 -42.5 14.62 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 169.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.607 HD21 ' SD ' ' A' ' 79' ' ' MET . 83.8 mt -63.77 -32.99 74.67 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 117.804 -1.093 . . . . 0.0 110.2 178.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 13.8 m -51.17 -28.88 12.23 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 171.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -67.9 -22.82 65.06 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.634 1.106 . . . . 0.0 110.845 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 49.6 mt -108.03 -60.81 1.67 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.744 1.218 . . . . 0.0 109.874 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.498 HD13 HD13 ' A' ' 59' ' ' LEU . 0.1 OUTLIER -52.14 -38.73 58.48 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 127.679 2.392 . . . . 0.0 114.19 178.098 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 56.5 m -95.06 24.99 4.45 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.481 1.037 . . . . 0.0 111.664 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -133.32 101.91 5.35 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 124.101 0.96 . . . . 0.0 108.808 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -58.16 -28.55 64.83 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.801 -179.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.35 -43.15 91.75 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.278 0.631 . . . . 0.0 110.049 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.56 -44.4 86.44 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.8 mt -56.29 -37.88 70.47 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 119.101 0.864 . . . . 0.0 111.319 -176.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -68.35 -40.33 81.57 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 118.907 0.776 . . . . 0.0 111.109 175.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -69.03 -34.76 75.75 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 118.797 0.726 . . . . 0.0 109.805 -177.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -65.96 -55.15 18.3 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 169.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 35.0 mt -56.19 -16.11 4.79 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.901 1.075 . . . . 0.0 113.901 -176.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 42.8 p -112.0 7.62 19.91 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.95 1.3 . . . . 0.0 110.806 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.49 117.78 6.16 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.631 1.572 . . . . 0.0 110.348 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 19.8 m -76.99 -15.36 59.66 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.721 0.808 . . . . 0.0 112.157 175.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 73.5 p -154.92 164.65 38.56 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 119.035 0.834 . . . . 0.0 110.986 -170.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -58.09 -37.11 73.88 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.856 0.862 . . . . 0.0 109.494 169.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -57.91 -45.53 86.35 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 122.659 0.384 . . . . 0.0 110.455 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.68 -33.87 76.9 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.3 mt -67.55 -51.49 50.14 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.065 0.848 . . . . 0.0 109.074 175.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.72 -24.4 67.76 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.096 0.958 . . . . 0.0 113.511 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -61.07 -44.67 97.02 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 120.712 -1.243 . . . . 0.0 109.776 172.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 89.9 mt -67.35 -35.51 73.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.166 0.986 . . . . 0.0 109.368 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . 0.555 HD11 HD22 ' A' ' 81' ' ' LEU . 41.2 mm -56.22 -53.77 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 169.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 20.3 m -64.66 -33.02 74.95 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 123.642 0.589 . . . . 0.0 110.624 -171.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -58.51 -45.06 89.55 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.779 1.631 . . . . 0.0 112.707 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.038 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 -169.785 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 tpt . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -65.91 110.11 2.76 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 168.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.38 -41.11 65.58 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.618 0.767 . . . . 0.0 110.447 -175.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.4 p -53.26 -21.62 5.68 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.583 1.553 . . . . 0.0 113.549 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -59.82 -25.0 64.61 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.664 1.12 . . . . 0.0 112.264 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -100.72 -10.97 20.33 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 117.57 -1.205 . . . . 0.0 113.126 -174.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -113.78 83.32 7.3 Favored Pre-proline 0 N--CA 1.474 0.768 0 CA-C-N 121.52 1.964 . . . . 0.0 107.479 -174.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -55.74 -54.18 4.53 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.864 3.042 . . . . 0.0 116.277 -169.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.466 ' C ' ' H ' ' A' ' 11' ' ' SER . 42.0 tt0 -157.88 -93.34 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.573 0.624 . . . . 0.0 112.589 -169.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 m -68.52 13.43 0.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.432 1.493 . . . . 0.0 111.365 177.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.466 ' H ' ' C ' ' A' ' 9' ' ' GLU . 11.2 m -62.03 -29.17 70.1 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.448 1.499 . . . . 0.0 111.229 -169.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.3 mp -105.84 129.93 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 -175.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 31.1 m -144.2 141.56 29.97 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 123.388 0.43 . . . . 0.0 110.351 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.4 t -112.6 135.41 52.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 169.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.41 HG22 ' H ' ' A' ' 17' ' ' SER . 30.9 mt -136.75 145.52 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -169.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.459 ' CE1' HE22 ' A' ' 86' ' ' GLN . 32.5 t-80 -59.4 -46.29 89.11 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.99 0.916 . . . . 0.0 111.82 174.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 15' ' ' ILE . 18.5 p -168.14 150.94 5.56 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.541 1.136 . . . . 0.0 108.161 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.21 144.26 30.8 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 168.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tppt? -72.32 -30.01 64.36 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 122.096 -0.378 . . . . 0.0 111.955 -175.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -163.81 173.18 13.1 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 127.388 2.275 . . . . 0.0 106.123 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -66.6 -33.95 76.8 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 119.252 -0.404 . . . . 0.0 110.504 169.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.412 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.4 mt-30 -59.06 -48.03 83.09 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 169.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -65.54 -33.56 76.21 Favored 'General case' 0 C--O 1.223 -0.292 0 O-C-N 121.788 -0.57 . . . . 0.0 111.52 -178.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.61 -37.77 88.6 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 121.81 -0.556 . . . . 0.0 109.686 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.1 -45.85 85.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -56.87 -44.95 82.75 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.035 0.534 . . . . 0.0 110.426 -174.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -67.62 -32.79 73.75 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 118.101 -0.952 . . . . 0.0 111.734 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.3 m -61.99 -21.16 64.61 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.64 1.109 . . . . 0.0 112.274 173.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.6 mmt -122.2 -23.94 5.2 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 -169.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -59.5 -34.57 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 120.912 1.687 . . . . 0.0 112.272 -170.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.1 m -63.1 -29.64 70.96 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.34 0.973 . . . . 0.0 111.723 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 71.5 mt -81.07 -40.66 23.8 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.153 0.981 . . . . 0.0 109.265 174.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.5 tp -56.58 -40.71 75.7 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.711 0.804 . . . . 0.0 110.628 177.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -66.54 -27.96 68.16 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 124.918 1.287 . . . . 0.0 113.068 -172.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -101.87 16.95 24.35 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 117.971 0.351 . . . . 0.0 110.486 173.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.423 0.0 OUTLIER 44.28 42.66 5.36 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.26 2.224 . . . . 0.0 115.807 -170.122 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -68.14 -19.29 64.81 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 120.974 -1.079 . . . . 0.0 110.193 168.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.9 pt -143.26 174.14 5.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 127.081 2.152 . . . . 0.0 108.125 -176.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 m -111.75 159.22 18.47 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.007 1.723 . . . . 0.0 107.722 171.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -60.99 -30.65 70.4 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.971 -1.08 . . . . 0.0 111.901 -176.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -57.97 -36.73 73.0 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.705 -0.622 . . . . 0.0 111.92 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -60.3 -45.11 94.51 Favored 'General case' 0 CA--C 1.527 0.09 0 C-N-CA 123.681 0.792 . . . . 0.0 110.015 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.8 mt -59.1 -51.05 77.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 124.725 1.21 . . . . 0.0 108.481 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.8 tp60 -67.97 -26.0 65.71 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.026 -0.988 . . . . 0.0 111.775 -175.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.33 -43.36 96.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 119.771 1.168 . . . . 0.0 110.658 173.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.2 mt -67.74 -48.81 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.4 mttt -59.34 -45.5 91.19 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.195 0.452 . . . . 0.0 109.841 -175.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.3 -42.78 96.21 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 124.222 1.009 . . . . 0.0 111.106 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.0 m -64.36 -42.9 95.97 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.135 0.425 . . . . 0.0 110.235 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 98.3 m . . . . . 0 CA--C 1.536 0.437 0 C-N-CA 124.573 1.149 . . . . 0.0 111.022 176.454 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 . . . . . 0 N--CA 1.452 -0.335 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.3 mm -125.65 127.02 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 103.713 -2.699 . . . . 0.0 103.713 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.9 mp -120.15 -21.99 6.8 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -169.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.56 159.36 31.72 Favored Pre-proline 0 C--O 1.236 0.368 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 170.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -62.24 104.83 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 121.682 1.588 . . . . 0.0 108.99 170.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.56 -10.04 16.68 Favored Glycine 0 CA--C 1.533 1.176 0 CA-C-O 117.958 -1.468 . . . . 0.0 113.973 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.8 t -132.91 123.06 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 119.632 1.716 . . . . 0.0 108.863 -170.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -117.73 167.17 11.61 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 126.114 1.766 . . . . 0.0 109.12 174.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.9 ttm -137.58 60.25 24.68 Favored Pre-proline 0 CA--C 1.548 0.888 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 177.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -53.53 141.79 61.63 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.262 1.975 . . . . 0.0 114.429 -172.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -175.75 156.66 1.88 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.552 2.741 . . . . 0.0 106.753 -171.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.62 162.03 33.86 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.863 1.665 . . . . 0.0 107.366 169.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -52.52 141.94 32.62 Favored Pre-proline 0 CA--C 1.537 0.454 0 CA-C-O 117.676 -1.154 . . . . 0.0 108.868 176.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -45.69 -41.13 19.29 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.818 3.012 . . . . 0.0 112.916 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -62.2 -13.06 23.73 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.465 1.506 . . . . 0.0 113.253 -177.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 62.1 m -78.25 -1.82 34.85 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.649 0.78 . . . . 0.0 111.583 177.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.41 17.46 2.4 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-O 118.433 -1.204 . . . . 0.0 112.96 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.58 145.83 55.58 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.3 1.55 . . . . 0.0 108.724 169.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.1 mt -128.46 -32.28 2.2 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 124.471 1.109 . . . . 0.0 110.425 -173.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -145.26 160.86 40.84 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.605 1.562 . . . . 0.0 108.438 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 82.2 m -94.54 127.76 40.7 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 123.195 0.598 . . . . 0.0 110.091 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -170.82 -176.45 40.12 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 125.204 1.383 . . . . 0.0 110.683 -175.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 49.2 mtt -148.26 171.81 15.36 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.095 1.758 . . . . 0.0 111.059 -174.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -139.15 168.25 20.25 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.131 1.773 . . . . 0.0 108.586 174.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.477 HD22 HD11 ' A' ' 144' ' ' ILE . 13.3 tp -148.77 83.31 1.46 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.699 2.0 . . . . 0.0 107.397 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 55.7 m -86.51 142.57 28.25 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 176.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.2 tt -136.59 116.9 13.58 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 169.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -89.1 132.24 34.89 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 172.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.06 -29.24 70.12 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 169.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.459 HE22 ' CE1' ' A' ' 16' ' ' HIS . 32.1 mt-30 -130.29 75.66 1.67 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.645 1.978 . . . . 0.0 107.331 -178.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -52.12 161.45 2.17 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 125.949 1.738 . . . . 0.0 113.835 175.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 48.9 t -127.6 147.58 32.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 C-N-CA 125.745 1.618 . . . . 0.0 107.426 -173.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -98.65 179.14 4.77 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 . . . . . 0 C--N 1.323 -0.558 0 C-N-CA 124.162 0.985 . . . . 0.0 111.744 -169.664 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo . . . . . 0 N--CA 1.448 -1.17 0 N-CA-C 110.493 -0.618 . . . . 0.0 110.493 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 49.6 mm -117.35 124.72 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -88.86 -33.34 17.38 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 117.178 -1.391 . . . . 0.0 109.434 169.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 mt -116.19 131.11 57.04 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-N 120.034 1.288 . . . . 0.0 112.025 -169.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mp -136.84 104.99 5.66 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.9 mp -87.51 112.34 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 175.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.18 153.88 47.15 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 172.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.43 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -147.27 133.97 19.97 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 169.176 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.43 ' N ' HD23 ' A' ' 103' ' ' LEU . 93.0 p -127.62 147.69 50.36 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 126.344 1.858 . . . . 0.0 106.925 168.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -147.25 132.87 18.79 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -178.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.16 -22.74 60.44 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.721 0.408 . . . . 0.0 111.962 179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -144.42 155.82 43.93 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.678 0.791 . . . . 0.0 110.036 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.36 74.87 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.22 -31.22 62.53 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 120.839 -1.163 . . . . 0.0 111.032 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.7 m -64.65 -39.05 93.01 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.937 -0.477 . . . . 0.0 110.136 170.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -58.84 -48.84 79.92 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 123.637 0.775 . . . . 0.0 109.873 172.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 16.0 mm -55.92 -53.83 33.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.25 -39.28 94.39 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 118.837 0.744 . . . . 0.0 112.03 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.96 -53.3 27.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.459 1.104 . . . . 0.0 110.582 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -51.35 -47.44 34.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.47 1.508 . . . . 0.0 108.637 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -67.62 -10.66 54.13 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.499 1.12 . . . . 0.0 112.555 -177.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -93.87 -46.17 7.31 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 123.973 0.909 . . . . 0.0 109.726 169.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.465 HD12 ' N ' ' A' ' 119' ' ' SER . 1.8 pp -72.66 -25.24 61.19 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 118.711 0.687 . . . . 0.0 112.108 -173.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . 0.465 ' N ' HD12 ' A' ' 118' ' ' LEU . 4.9 p -61.18 -20.91 63.29 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.177 0.591 . . . . 0.0 112.152 172.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -65.7 -19.17 65.8 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.391 0.996 . . . . 0.0 110.098 172.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 36.5 mt -106.54 -63.29 1.29 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.639 1.576 . . . . 0.0 110.178 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.5 -23.85 59.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.533 1.933 . . . . 0.0 114.528 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.0 m -112.48 28.15 9.03 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 118.95 0.796 . . . . 0.0 110.165 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -132.89 102.57 5.69 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.863 0.865 . . . . 0.0 108.903 177.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -57.85 -26.92 62.72 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.938 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -62.09 -45.0 95.45 Favored 'General case' 0 C--N 1.34 0.152 0 C-N-CA 123.893 0.877 . . . . 0.0 110.123 174.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -69.06 -46.35 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 CA-C-O 117.961 -1.019 . . . . 0.0 108.728 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 8.8 mp -50.56 -44.18 56.57 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 119.541 1.064 . . . . 0.0 112.672 -176.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -71.25 -34.38 70.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 118.63 0.65 . . . . 0.0 110.384 -178.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -72.76 -34.43 67.0 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 121.404 -0.81 . . . . 0.0 109.68 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 55.7 mt -65.6 -53.47 41.27 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.9 mt -56.78 -32.43 65.64 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -174.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 37.2 p -88.24 -0.53 57.22 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.076 0.95 . . . . 0.0 112.26 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.87 138.64 57.22 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 119.127 0.876 . . . . 0.0 110.178 176.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.0 m -124.57 9.07 8.35 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.943 1.297 . . . . 0.0 110.754 176.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 74.8 p -152.16 153.66 34.31 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.491 1.116 . . . . 0.0 108.916 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -62.21 -32.12 72.74 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -58.07 -40.99 82.42 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.191 0.597 . . . . 0.0 111.842 176.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 14.3 tp60 -74.56 -30.89 61.91 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 119.429 1.013 . . . . 0.0 110.738 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.77 -50.15 52.82 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.407 1.003 . . . . 0.0 108.924 173.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.36 -31.1 65.41 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.515 1.126 . . . . 0.0 112.892 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -61.93 -45.85 91.88 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 120.842 -1.161 . . . . 0.0 110.038 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 95.7 mt -65.49 -37.2 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 123.987 0.915 . . . . 0.0 109.739 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . 0.477 HD11 HD22 ' A' ' 81' ' ' LEU . 40.2 mm -56.24 -49.56 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-N 118.23 0.468 . . . . 0.0 110.128 169.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 39.2 m -66.84 -26.26 66.83 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -169.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -67.41 -34.86 78.11 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.776 0.717 . . . . 0.0 111.252 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.926 0 CA-C-O 117.815 -1.547 . . . . 0.0 110.375 -169.257 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tpp . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.705 0.288 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.34 106.45 1.71 Allowed 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 169.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.4 -42.9 96.88 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 175.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -56.03 -24.04 36.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.41 1.084 . . . . 0.0 112.773 -178.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.81 -22.68 66.8 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.097 0.862 . . . . 0.0 112.688 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -106.0 -10.2 16.69 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-O 116.52 -1.705 . . . . 0.0 113.593 -170.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -115.47 91.01 27.34 Favored Pre-proline 0 N--CA 1.477 0.925 0 CA-C-N 122.729 2.513 . . . . 0.0 108.433 -174.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -42.07 -75.07 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.804 1 C-N-CA 125.537 4.158 . . . . 0.0 116.795 -171.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.472 ' C ' ' H ' ' A' ' 11' ' ' SER . 8.0 tp10 -162.09 -76.69 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 124.032 0.933 . . . . 0.0 111.114 -173.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.1 m -66.86 6.35 0.51 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.544 1.537 . . . . 0.0 111.803 175.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.472 ' H ' ' C ' ' A' ' 9' ' ' GLU . 3.8 m -74.91 1.52 12.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 128.452 2.701 . . . . 0.0 113.247 -169.04 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.5 mt -130.69 131.82 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 -172.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.5 p -151.61 155.6 38.73 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 122.052 0.929 . . . . 0.0 111.347 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -127.59 136.1 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 103.297 -2.853 . . . . 0.0 103.297 169.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.1 mt -134.89 147.39 29.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 106.46 -1.682 . . . . 0.0 106.46 -169.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -63.24 -47.93 80.37 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.938 -0.476 . . . . 0.0 110.631 174.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 p -166.51 147.42 6.23 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -172.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.15 149.89 30.39 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 169.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -60.19 -41.03 92.07 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.02 0.528 . . . . 0.0 110.818 178.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -166.02 179.9 5.55 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 127.09 2.156 . . . . 0.0 107.658 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -64.61 -31.6 72.89 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.021 0.929 . . . . 0.0 112.567 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.433 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.2 mt-30 -62.95 -49.43 74.76 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 120.265 1.393 . . . . 0.0 107.872 169.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.47 -34.77 74.51 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 121.887 -0.508 . . . . 0.0 111.67 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.63 -35.52 79.85 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.936 -0.478 . . . . 0.0 110.124 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -71.27 -45.85 68.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 172.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -55.58 -44.71 77.17 Favored 'General case' 0 C--O 1.225 -0.203 0 O-C-N 121.747 -0.596 . . . . 0.0 110.8 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -65.76 -33.35 75.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.753 174.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.5 m -63.32 -19.91 65.03 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.638 1.108 . . . . 0.0 112.479 172.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.8 mmt -124.68 -20.97 4.92 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -168.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -59.66 -36.99 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 120.788 1.631 . . . . 0.0 111.916 -169.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.3 m -66.57 -19.79 65.86 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.941 0.791 . . . . 0.0 112.183 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.9 mt -86.03 -44.44 12.3 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 123.927 0.891 . . . . 0.0 109.072 170.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -56.38 -42.92 78.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.959 0.904 . . . . 0.0 110.772 -178.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -67.59 -23.03 65.34 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 125.758 1.623 . . . . 0.0 113.942 -170.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -115.38 26.44 10.07 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 122.558 0.343 . . . . 0.0 110.454 171.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 60.89 27.15 17.0 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 170.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -67.21 -22.15 65.73 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.133 -0.979 . . . . 0.0 110.814 169.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 pt -143.35 170.27 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 126.165 1.786 . . . . 0.0 108.879 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.6 m -102.63 158.79 15.99 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.304 1.841 . . . . 0.0 108.385 171.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.29 -32.43 70.03 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.227 -0.92 . . . . 0.0 112.372 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -58.23 -32.83 68.7 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.764 -0.585 . . . . 0.0 111.954 175.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -60.74 -42.65 97.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.586 0.754 . . . . 0.0 110.435 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -59.69 -50.8 78.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.3 tp60 -69.11 -27.58 65.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.59 -0.719 . . . . 0.0 111.915 -173.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.17 -40.98 78.39 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.016 0.826 . . . . 0.0 110.757 174.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.5 mt -72.6 -49.23 42.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.433 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 90.8 mttt -58.36 -41.24 84.27 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 119.448 -0.31 . . . . 0.0 110.443 -175.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -59.39 -52.74 64.32 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.463 0.705 . . . . 0.0 111.051 -173.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.5 m -64.64 -40.69 95.91 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.789 0.436 . . . . 0.0 110.481 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 CA--C 1.535 0.375 0 CA-C-O 119.098 -0.477 . . . . 0.0 111.671 178.273 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 . . . . . 0 N--CA 1.456 -0.151 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 50.2 mm -119.66 139.0 48.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 177.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mp -130.77 -25.18 2.35 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -169.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -158.5 161.86 27.74 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 173.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -48.64 118.38 3.34 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.775 2.317 . . . . 0.0 110.807 169.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.98 3.19 88.0 Favored Glycine 0 CA--C 1.533 1.199 0 CA-C-O 117.799 -1.556 . . . . 0.0 114.931 178.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 26.2 t -132.03 126.19 56.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-N 120.067 1.934 . . . . 0.0 108.882 -172.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.07 168.38 15.43 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.155 1.782 . . . . 0.0 109.768 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.45 ' CE ' HD11 ' A' ' 118' ' ' LEU . 5.4 ttm -137.31 60.41 26.97 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.035 0.934 . . . . 0.0 110.397 175.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -57.13 123.57 14.14 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 121.911 1.741 . . . . 0.0 110.362 -174.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.54 161.41 3.27 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.546 2.338 . . . . 0.0 106.855 -169.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -136.43 173.67 11.46 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.99 1.316 . . . . 0.0 109.343 -173.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 67.3 mtp85 -59.04 154.71 37.73 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 118.702 -0.666 . . . . 0.0 109.608 172.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.13 -39.59 84.08 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.204 1.936 . . . . 0.0 109.517 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -64.12 -12.92 44.12 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.558 1.543 . . . . 0.0 113.196 -177.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 73.6 m -77.17 -3.24 38.5 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.079 0.854 . . . . 0.0 111.784 177.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.85 19.6 1.98 Allowed Glycine 0 C--N 1.336 0.568 0 CA-C-O 118.245 -1.308 . . . . 0.0 112.689 173.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.75 145.32 56.13 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 119.502 1.651 . . . . 0.0 108.984 169.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -130.34 -30.57 1.92 Allowed 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 124.0 0.92 . . . . 0.0 111.047 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 mttt -148.04 155.6 41.68 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.939 1.296 . . . . 0.0 107.93 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 89.8 m -87.37 130.65 34.56 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 122.957 0.503 . . . . 0.0 111.592 -176.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -177.04 -177.98 46.4 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 125.173 1.368 . . . . 0.0 110.82 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.408 ' HG2' ' HA ' ' A' ' 103' ' ' LEU . 13.3 mtm -149.99 171.83 16.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 127.195 2.198 . . . . 0.0 109.731 -176.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.2 m -151.09 167.95 26.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.705 1.202 . . . . 0.0 109.273 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.7 tp -144.94 98.87 3.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 126.445 1.898 . . . . 0.0 108.468 -169.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 28.1 m -103.97 143.47 32.83 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.408 1.083 . . . . 0.0 108.69 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.4 tt -133.84 134.29 42.61 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 171.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -103.24 133.82 47.69 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.045 0.938 . . . . 0.0 108.653 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -67.62 -29.61 68.98 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 168.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -130.71 82.53 2.06 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 127.099 2.16 . . . . 0.0 106.796 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -46.98 157.61 0.53 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 113.083 -1.871 . . . . 0.0 113.743 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 95.5 t -123.8 150.68 28.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 -174.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -112.19 98.46 7.33 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.107 0.963 . . . . 0.0 110.663 -168.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 . . . . . 0 CA--C 1.538 0.492 0 C-N-CA 124.322 1.049 . . . . 0.0 110.827 169.928 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo . . . . . 0 CA--C 1.534 0.521 0 CA-C-O 120.863 0.276 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 25.5 mm -92.46 131.38 39.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 173.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -101.06 -19.31 15.86 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 116.351 -1.785 . . . . 0.0 110.923 169.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.7 mt -130.48 134.35 47.01 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 121.513 1.961 . . . . 0.0 111.887 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.7 mp -139.86 109.78 6.41 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -174.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.8 mp -92.34 119.23 39.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 175.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.36 153.03 34.9 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 170.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.547 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -151.38 143.55 24.01 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 170.567 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.547 ' N ' HD23 ' A' ' 103' ' ' LEU . 79.4 p -142.73 146.31 34.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 168.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.625 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -144.91 145.94 31.79 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 118.915 0.78 . . . . 0.0 109.716 170.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.69 -13.11 59.71 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.538 -0.465 . . . . 0.0 111.351 -176.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -137.04 151.26 48.72 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.63 0.772 . . . . 0.0 110.024 175.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.51 77.54 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -177.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -72.34 -30.03 64.37 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.119 -0.988 . . . . 0.0 110.946 176.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.442 ' HB2' ' HB1' ' A' ' 105' ' ' ALA . 20.0 m -66.94 -35.55 80.24 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.79 -0.569 . . . . 0.0 110.444 169.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.625 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 28.5 m-70 -62.19 -45.0 95.34 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.343 0.974 . . . . 0.0 109.85 170.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.1 mm -56.32 -52.03 56.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 118.946 0.794 . . . . 0.0 109.267 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.37 -39.69 95.08 Favored Glycine 0 CA--C 1.529 0.939 0 CA-C-N 118.945 0.793 . . . . 0.0 111.81 -177.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.86 67.46 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.411 0.684 . . . . 0.0 110.874 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.6 mm -58.04 -46.23 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 C-N-CA 124.607 1.163 . . . . 0.0 108.167 176.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -68.21 -12.04 60.29 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.139 -0.975 . . . . 0.0 111.527 -177.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.57 -48.58 6.54 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 124.276 1.031 . . . . 0.0 109.546 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.45 HD11 ' CE ' ' A' ' 65' ' ' MET . 4.2 pp -68.83 -28.3 66.61 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.643 -177.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.7 m -61.7 -20.21 63.22 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 118.822 -0.609 . . . . 0.0 112.393 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -67.19 -14.49 62.95 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.611 1.096 . . . . 0.0 110.734 171.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 32.6 mt -111.68 -59.51 1.97 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.683 1.593 . . . . 0.0 110.734 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.1 -37.25 74.16 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.669 1.188 . . . . 0.0 113.125 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 42.3 m -100.7 25.46 7.84 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.557 0.343 . . . . 0.0 110.679 -172.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -133.95 99.08 4.33 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 124.676 1.191 . . . . 0.0 108.121 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -57.04 -27.28 61.53 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.476 0.71 . . . . 0.0 112.309 -178.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -64.0 -43.14 96.56 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.277 0.631 . . . . 0.0 110.065 175.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.3 mp -70.6 -42.83 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.2 mt -53.6 -40.43 65.68 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 119.247 0.93 . . . . 0.0 112.262 -175.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -71.56 -33.99 69.59 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 118.847 0.748 . . . . 0.0 110.569 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -72.31 -33.74 67.6 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 121.418 -0.801 . . . . 0.0 109.733 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -66.19 -53.92 31.5 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 26.8 mt -55.78 -30.22 60.95 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.136 0.574 . . . . 0.0 112.54 -174.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 32.1 p -91.56 2.86 56.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.273 1.029 . . . . 0.0 112.131 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.81 104.26 0.81 Allowed 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.465 1.106 . . . . 0.0 110.564 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 11.7 m -69.05 -26.61 65.05 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.37 0.668 . . . . 0.0 111.78 175.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.9 m -148.17 159.28 44.11 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.271 1.428 . . . . 0.0 108.954 -172.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -54.43 -31.66 55.8 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.36 1.464 . . . . 0.0 112.021 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -56.05 -34.46 65.92 Favored 'General case' 0 C--O 1.227 -0.083 0 C-N-CA 123.298 0.639 . . . . 0.0 112.616 -177.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -80.98 -26.47 36.51 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 119.451 1.023 . . . . 0.0 110.547 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 82.1 mt -71.07 -48.86 50.18 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 173.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -54.85 -38.55 67.6 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.893 1.277 . . . . 0.0 112.711 171.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -59.16 -47.73 84.24 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 118.941 0.791 . . . . 0.0 110.196 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 67.2 mt -65.91 -37.01 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 123.537 0.735 . . . . 0.0 110.292 -178.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 20.9 mm -57.32 -53.55 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 169.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 83.8 p -64.01 -29.5 70.65 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.129 0.49 . . . . 0.0 111.989 -169.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -57.93 -26.39 62.16 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.331 1.852 . . . . 0.0 113.342 176.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.876 0 N-CA-C 108.538 -1.825 . . . . 0.0 108.538 -177.684 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.3 tpt . . . . . 0 N--CA 1.488 1.433 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -67.15 114.56 6.0 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 169.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.32 -38.58 68.88 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 125.037 1.335 . . . . 0.0 110.038 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.86 -20.94 9.83 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.442 1.497 . . . . 0.0 112.891 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.84 -31.92 71.25 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 119.088 0.858 . . . . 0.0 112.508 175.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -87.08 -27.14 23.32 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 118.486 -0.768 . . . . 0.0 112.765 -171.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -91.42 104.31 9.66 Favored Pre-proline 0 CA--C 1.542 0.651 0 N-CA-C 103.801 -2.666 . . . . 0.0 103.801 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -63.46 -68.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.099 1.866 . . . . 0.0 113.686 -168.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -164.09 161.16 22.27 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.358 1.863 . . . . 0.0 106.38 171.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.0 m 53.07 22.87 2.7 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.34 1.056 . . . . 0.0 112.949 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.4 m -114.56 24.05 12.19 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 125.406 1.482 . . . . 0.0 110.691 -169.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.8 mt -131.52 129.69 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 103.863 -2.643 . . . . 0.0 103.863 178.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 m -150.38 149.24 29.8 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.475 0.71 . . . . 0.0 111.109 -173.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.7 t -123.65 142.61 39.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 169.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.6 mt -142.27 148.91 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 126.316 1.846 . . . . 0.0 106.168 -169.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -73.6 -46.58 46.23 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.553 -0.717 . . . . 0.0 109.911 172.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 p -163.21 144.47 9.57 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.54 158.61 33.44 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 169.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -58.18 -42.01 85.13 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.894 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -167.26 -177.43 3.66 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 127.931 2.492 . . . . 0.0 107.546 172.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -63.26 -33.18 74.95 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.493 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.6 mt-30 -60.29 -49.75 76.38 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 120.558 1.526 . . . . 0.0 107.433 173.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -61.88 -34.06 75.34 Favored 'General case' 0 C--O 1.221 -0.396 0 O-C-N 121.588 -0.695 . . . . 0.0 111.378 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.23 -32.01 71.91 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.658 -0.651 . . . . 0.0 111.262 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -46.4 82.84 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 171.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -56.51 -44.88 81.16 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.724 -0.61 . . . . 0.0 110.096 176.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -68.63 -13.92 62.68 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.216 -0.928 . . . . 0.0 113.083 174.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.5 m -82.96 -17.54 43.15 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.664 1.574 . . . . 0.0 111.592 169.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 3.3 mmt -130.35 -16.65 3.48 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -168.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.6 p -56.28 -37.02 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 120.173 1.351 . . . . 0.0 113.07 -169.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.2 m -68.33 -29.8 68.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.049 0.84 . . . . 0.0 111.645 -178.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 mt -75.91 -41.14 52.76 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 172.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.3 tp -58.46 -45.72 88.01 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.389 0.676 . . . . 0.0 110.568 179.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -60.15 -35.5 75.45 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.523 1.129 . . . . 0.0 112.118 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -96.54 17.25 16.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.738 -177.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.287 3.5 p30 43.06 38.17 1.39 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.941 1.696 . . . . 0.0 113.502 -176.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.438 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 24.3 m-85 -73.21 -18.05 61.29 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 168.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.9 pt -145.98 166.95 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 127.113 2.165 . . . . 0.0 108.522 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 p -94.84 165.03 12.67 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.52 1.128 . . . . 0.0 109.24 169.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.99 -35.64 75.45 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.279 -0.888 . . . . 0.0 111.066 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.06 -21.33 66.37 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.205 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -62.0 -42.72 99.46 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.526 1.057 . . . . 0.0 110.0 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -58.86 -50.3 79.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 123.45 0.7 . . . . 0.0 109.207 175.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 32.2 tp60 -70.36 -24.76 63.02 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.924 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.42 -42.86 92.83 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.406 1.003 . . . . 0.0 110.252 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 74.5 mt -66.95 -47.15 83.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.493 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 93.2 mttt -60.72 -37.78 82.88 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.012 -177.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.53 -46.94 88.32 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 119.003 0.82 . . . . 0.0 111.301 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 46.2 m -68.48 -29.85 68.56 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.578 -0.701 . . . . 0.0 111.405 174.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 37.8 m . . . . . 0 CA--C 1.54 0.57 0 CA-C-N 118.279 0.491 . . . . 0.0 110.172 174.828 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 . . . . . 0 C--O 1.231 0.129 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.1 mm -140.4 138.48 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 177.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -123.27 -32.24 3.45 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.294 0.638 . . . . 0.0 111.692 -169.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.03 158.97 24.73 Favored Pre-proline 0 C--O 1.237 0.433 0 C-N-CA 126.927 2.091 . . . . 0.0 105.627 -175.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -60.0 117.04 3.74 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 121.505 1.47 . . . . 0.0 109.541 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 94.48 6.33 61.19 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.349 -1.25 . . . . 0.0 113.641 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.0 t -130.62 122.5 52.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 119.477 1.639 . . . . 0.0 108.197 -171.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.9 167.52 14.55 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.575 1.55 . . . . 0.0 109.461 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.425 ' CE ' HD13 ' A' ' 118' ' ' LEU . 12.8 ttm -143.38 66.81 16.23 Favored Pre-proline 0 C--N 1.331 -0.219 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 175.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -58.69 147.51 87.28 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 CA-C-O 122.472 0.947 . . . . 0.0 111.511 -173.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -179.54 155.02 0.65 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 128.365 2.666 . . . . 0.0 105.444 -169.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -133.9 153.74 51.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 169.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -54.45 145.14 39.49 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-O 117.685 -1.15 . . . . 0.0 109.377 -177.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -44.46 -44.91 13.21 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 123.818 3.012 . . . . 0.0 113.204 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.0 -14.51 48.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.617 1.567 . . . . 0.0 113.151 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 65.3 m -73.64 -25.24 60.19 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 118.613 0.642 . . . . 0.0 110.771 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 150.97 17.35 0.07 OUTLIER Glycine 0 C--N 1.337 0.609 0 CA-C-O 118.295 -1.28 . . . . 0.0 114.154 -178.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.22 152.54 44.94 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.142 1.471 . . . . 0.0 109.372 169.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.2 mt -131.65 -31.86 1.53 Allowed 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 124.128 0.971 . . . . 0.0 110.724 -175.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.438 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 75.3 mttt -146.68 158.24 43.87 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 125.628 1.571 . . . . 0.0 108.496 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.3 m -92.15 122.84 35.03 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.086 0.554 . . . . 0.0 110.184 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.07 -176.15 38.92 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.697 1.141 . . . . 0.0 111.02 -177.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 51.7 mtt -145.85 172.31 13.52 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.397 1.479 . . . . 0.0 110.64 -176.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 70.2 m -149.5 160.41 43.49 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.802 1.241 . . . . 0.0 109.06 169.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.4 tp -136.47 121.27 18.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.177 1.791 . . . . 0.0 108.892 -172.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.478 ' O ' HD22 ' A' ' 99' ' ' LEU . 91.5 m -137.63 129.76 29.09 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -171.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.2 tp -122.89 139.1 54.4 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.8 mp -119.84 118.81 31.77 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 126.559 1.944 . . . . 0.0 106.433 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -60.12 -24.5 64.73 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.769 0.827 . . . . 0.0 113.007 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -115.58 -9.28 12.04 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.63 1.172 . . . . 0.0 111.946 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 61.17 -176.98 4.51 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 123.734 0.683 . . . . 0.0 112.119 -169.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -149.6 160.62 5.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 169.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -105.32 108.33 19.78 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.519 0.676 . . . . 0.0 110.96 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 . . . . . 0 N--CA 1.448 -0.532 0 C-N-CA 124.572 1.149 . . . . 0.0 108.396 170.133 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo . . . . . 0 N--CA 1.456 -0.681 0 N-CA-C 111.031 -0.411 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 22.1 mm -87.13 131.9 33.87 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt -103.88 -25.76 12.93 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.97 169.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.478 HD22 ' O ' ' A' ' 82' ' ' THR . 3.0 tm? -134.06 132.27 39.81 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 120.655 1.57 . . . . 0.0 109.966 -174.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -131.24 126.76 36.33 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -174.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.0 mt -109.84 103.59 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 169.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -66.6 146.8 49.05 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 169.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.457 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -143.0 138.07 29.76 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 104.907 -2.257 . . . . 0.0 104.907 169.568 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.457 ' N ' HD23 ' A' ' 103' ' ' LEU . 94.9 p -131.34 147.95 52.62 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 126.139 1.775 . . . . 0.0 106.762 168.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -147.33 135.35 21.37 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.26 -21.52 58.5 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.753 0.421 . . . . 0.0 111.81 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -144.66 155.8 43.78 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.02 0.928 . . . . 0.0 109.825 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.18 -35.42 75.34 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.0 -31.05 62.78 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 120.894 -1.128 . . . . 0.0 111.064 176.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.8 m -64.8 -38.34 90.64 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.926 -0.484 . . . . 0.0 110.33 170.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -59.31 -49.72 76.76 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 123.521 0.729 . . . . 0.0 109.662 171.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.2 mm -55.37 -52.61 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.03 -39.72 96.07 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-N 119.098 0.863 . . . . 0.0 112.093 -177.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.85 -52.82 32.36 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.291 1.036 . . . . 0.0 110.635 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.9 mm -51.8 -47.86 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 C-N-CA 125.414 1.485 . . . . 0.0 108.571 174.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -67.45 -9.96 46.94 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 120.931 -1.106 . . . . 0.0 112.31 -177.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -91.46 -49.95 6.05 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 169.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.534 HD12 ' N ' ' A' ' 119' ' ' SER . 1.0 OUTLIER -70.77 -22.84 62.34 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -173.456 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . 0.534 ' N ' HD12 ' A' ' 118' ' ' LEU . 33.7 m -62.95 -25.68 68.47 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.673 0.789 . . . . 0.0 111.135 172.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -66.75 -22.89 66.04 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.582 -0.699 . . . . 0.0 109.427 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 32.1 mt -95.04 -71.92 0.65 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.208 1.003 . . . . 0.0 110.621 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 22.5 mt -68.57 -16.47 63.87 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -169.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 32.1 m -97.28 27.75 4.02 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 120.176 1.353 . . . . 0.0 111.423 177.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -132.4 112.86 12.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.209 1.804 . . . . 0.0 106.388 173.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -61.89 -26.21 68.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.981 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -64.15 -42.87 96.59 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.006 0.523 . . . . 0.0 109.99 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.93 -43.21 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 123.689 0.796 . . . . 0.0 109.146 175.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 46.4 mt -55.02 -42.27 72.39 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 118.934 0.788 . . . . 0.0 111.095 -176.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -69.12 -36.5 77.56 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 118.579 -0.724 . . . . 0.0 111.015 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -65.21 -40.25 93.89 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 119.627 1.103 . . . . 0.0 108.951 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 24.6 mt -66.95 -52.6 40.97 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 176.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 54.9 mt -63.61 -9.0 11.42 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 61.1 p -122.7 10.48 9.66 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.688 1.195 . . . . 0.0 111.356 176.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.93 113.22 2.67 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 124.289 1.036 . . . . 0.0 109.72 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.5 m -74.63 -15.38 60.82 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.864 0.866 . . . . 0.0 112.212 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 85.8 p -153.05 163.09 40.48 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.894 0.854 . . . . 0.0 111.599 -173.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -58.04 -37.61 74.72 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.883 1.273 . . . . 0.0 109.494 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -60.67 -41.41 95.02 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 123.102 0.561 . . . . 0.0 110.945 175.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -65.38 -36.32 83.64 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 118.752 0.706 . . . . 0.0 112.138 176.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 36.4 mt -65.28 -46.93 78.47 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.641 1.11 . . . . 0.0 108.69 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.66 -32.97 67.83 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.921 0.888 . . . . 0.0 113.203 172.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -67.58 -40.52 84.84 Favored 'General case' 0 C--N 1.33 -0.243 0 O-C-N 121.103 -0.998 . . . . 0.0 110.412 177.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 71.1 mt -66.52 -36.76 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 123.777 0.831 . . . . 0.0 109.427 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.0 mm -58.61 -52.11 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 169.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 22.7 m -63.88 -27.78 69.39 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.259 0.224 . . . . 0.0 111.415 -173.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -60.09 -26.31 66.09 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.399 1.48 . . . . 0.0 113.104 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.867 0 N-CA-C 108.662 -1.775 . . . . 0.0 108.662 -178.643 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 tpp . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.4 mmm-85 -65.53 117.23 7.71 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 169.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.27 -44.92 94.91 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 177.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.3 p -56.36 -19.75 16.09 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.295 1.038 . . . . 0.0 113.187 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.25 -26.6 68.86 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.738 1.153 . . . . 0.0 112.338 174.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -96.87 -23.41 16.37 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 118.241 -0.885 . . . . 0.0 112.852 -172.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -101.81 101.55 18.76 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 120.298 1.408 . . . . 0.0 107.331 -173.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.55 -64.44 0.08 OUTLIER 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.378 2.719 . . . . 0.0 115.164 -169.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.439 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.9 tp10 -158.94 -77.68 0.07 Allowed 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.74 0.816 . . . . 0.0 111.908 -172.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.23 10.86 0.27 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.089 1.355 . . . . 0.0 111.502 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.439 ' H ' ' C ' ' A' ' 9' ' ' GLU . 1.8 p -79.27 12.09 2.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.149 2.18 . . . . 0.0 113.329 -169.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 mp -135.24 130.11 50.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 173.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.6 m -144.35 153.76 42.31 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.034 0.534 . . . . 0.0 110.866 175.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 74.1 t -122.81 142.23 40.14 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 106.182 -1.784 . . . . 0.0 106.182 170.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.4 mt -140.59 146.11 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 -170.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 48.8 m-70 -65.42 -51.94 56.8 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 174.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -159.0 147.63 18.3 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.497 ' HB3' HG21 ' A' ' 88' ' ' VAL . . . -76.06 149.84 37.42 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 171.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 tmmm? -58.2 -39.22 78.39 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.029 0.532 . . . . 0.0 109.788 177.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -161.67 175.93 11.5 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 126.465 1.906 . . . . 0.0 107.937 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -69.16 -33.69 73.8 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 123.364 0.665 . . . . 0.0 111.552 174.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.405 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 4.8 pt20 -61.18 -41.82 97.48 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 119.858 1.208 . . . . 0.0 108.884 169.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -67.44 -32.89 74.06 Favored 'General case' 0 C--O 1.223 -0.319 0 O-C-N 121.606 -0.684 . . . . 0.0 111.561 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -34.83 78.94 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.946 0.498 . . . . 0.0 110.005 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.34 -46.79 80.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 169.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -55.12 -47.23 75.33 Favored 'General case' 0 C--O 1.226 -0.171 0 C-N-CA 122.954 0.501 . . . . 0.0 110.047 -176.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -66.28 -31.37 72.13 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.441 174.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.8 m -61.87 -22.49 65.58 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.918 1.235 . . . . 0.0 112.032 172.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.2 mmt -123.06 -17.51 6.67 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -169.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.34 -36.51 52.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 120.619 1.554 . . . . 0.0 113.019 -169.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.6 m -67.31 -31.76 72.27 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.989 0.813 . . . . 0.0 110.932 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 73.3 mt -73.49 -40.95 63.7 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.748 0.819 . . . . 0.0 109.106 173.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.0 tp -59.34 -44.61 92.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.455 0.702 . . . . 0.0 110.495 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -64.25 -42.51 96.48 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 124.222 1.009 . . . . 0.0 111.693 -176.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.3 13.7 3.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.98 1.312 . . . . 0.0 111.735 175.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.301 6.2 p30 44.51 37.47 2.13 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.68 1.992 . . . . 0.0 114.944 -176.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -69.9 -18.94 63.42 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.088 -1.008 . . . . 0.0 109.492 168.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.7 pt -145.86 168.33 7.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 126.736 2.014 . . . . 0.0 108.766 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 m -106.13 162.02 14.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.775 1.63 . . . . 0.0 108.695 169.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -58.78 -36.88 75.15 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.172 -0.955 . . . . 0.0 112.28 -174.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -59.99 -24.08 64.16 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.893 0.877 . . . . 0.0 113.007 175.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -63.74 -46.16 86.59 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 119.485 1.039 . . . . 0.0 110.264 175.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.5 -47.92 90.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -66.94 -27.66 67.65 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 118.473 -0.775 . . . . 0.0 111.774 -175.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.35 74.33 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.323 0.965 . . . . 0.0 111.691 173.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 26.1 mt -76.12 -50.59 22.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 82.3 mttt -57.89 -44.68 86.86 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 -173.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.9 -50.69 71.2 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.377 0.671 . . . . 0.0 111.071 -172.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.5 m -66.2 -38.74 88.72 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 118.051 0.387 . . . . 0.0 110.744 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.1 m . . . . . 0 CA--C 1.533 0.294 0 C-N-CA 123.137 0.575 . . . . 0.0 111.012 174.479 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 . . . . . 0 N--CA 1.457 -0.106 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.5 mm -124.29 136.64 59.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -122.25 -30.38 4.01 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.304 0.642 . . . . 0.0 111.666 -169.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.59 160.91 27.73 Favored Pre-proline 0 C--O 1.236 0.351 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -57.08 113.51 1.51 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 121.857 1.704 . . . . 0.0 108.959 169.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.22 -8.94 49.52 Favored Glycine 0 CA--C 1.531 1.088 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.187 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.2 t -129.48 125.1 61.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 CA-C-N 119.943 1.871 . . . . 0.0 109.831 -169.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -123.68 167.99 13.25 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 125.687 1.595 . . . . 0.0 109.684 175.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 ttm -141.86 62.27 14.22 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -49.58 142.3 24.41 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.417 2.078 . . . . 0.0 114.421 -175.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 179.93 153.7 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 128.754 2.822 . . . . 0.0 106.256 -171.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.92 159.26 42.01 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 125.741 1.616 . . . . 0.0 107.609 169.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 32.1 mtp-105 -51.16 142.66 18.37 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-O 117.707 -1.139 . . . . 0.0 109.203 177.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_exo -45.53 -42.02 18.38 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.716 2.944 . . . . 0.0 113.091 -178.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -61.31 -14.48 27.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.429 1.492 . . . . 0.0 113.336 -177.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.9 m -77.76 -9.27 58.92 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.588 0.755 . . . . 0.0 112.011 -178.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 137.12 17.28 0.71 Allowed Glycine 0 CA--C 1.527 0.82 0 CA-C-O 118.195 -1.336 . . . . 0.0 113.868 178.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.97 149.38 47.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.801 1.8 . . . . 0.0 109.463 169.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.2 mt -129.43 -35.86 1.72 Allowed 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.781 1.233 . . . . 0.0 110.146 -176.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -144.76 158.93 43.6 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.502 1.521 . . . . 0.0 108.49 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 76.1 m -90.97 127.25 36.34 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.147 0.579 . . . . 0.0 110.367 -178.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -170.98 -178.69 41.7 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.978 1.275 . . . . 0.0 110.836 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 37.9 mtt -145.44 170.36 16.53 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.675 1.59 . . . . 0.0 110.713 -177.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.8 m -152.79 171.5 18.16 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.355 1.462 . . . . 0.0 109.245 169.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.9 tp -143.81 128.86 18.6 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 127.052 2.141 . . . . 0.0 107.895 -169.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 90.5 m -130.46 143.14 50.57 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.057 1.343 . . . . 0.0 107.554 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.2 tp -134.17 143.33 47.83 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 171.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -113.3 137.73 51.06 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.591 1.156 . . . . 0.0 108.724 176.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -69.36 -40.98 77.15 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 168.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -118.92 96.35 5.21 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.964 2.106 . . . . 0.0 107.996 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -50.85 156.96 2.51 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.002 1.286 . . . . 0.0 112.942 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.497 HG21 ' HB3' ' A' ' 18' ' ' ALA . 84.1 t -118.84 152.78 21.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -113.85 93.95 4.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.899 0.879 . . . . 0.0 110.458 -167.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 . . . . . 0 CA--C 1.538 0.508 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.078 169.838 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo . . . . . 0 CA--C 1.531 0.353 0 N-CA-C 113.391 0.497 . . . . 0.0 113.391 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 39.9 mm -111.42 132.83 58.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -105.44 -15.4 15.03 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 117.347 -1.311 . . . . 0.0 110.973 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 46.4 tp -140.21 131.08 25.99 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 120.279 1.4 . . . . 0.0 109.979 -169.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.8 mp -137.53 138.87 40.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -176.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 3.7 mt -118.03 119.88 62.81 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 169.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.21 148.47 32.88 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.964 -1.654 . . . . 0.0 108.964 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.413 HD12 HD21 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -143.13 136.79 28.59 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 104.402 -2.444 . . . . 0.0 104.402 169.445 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.0 p -129.95 147.48 51.71 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 106.43 -1.692 . . . . 0.0 106.43 169.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.3 136.35 23.56 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 118.911 0.778 . . . . 0.0 109.244 -176.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.19 -22.63 55.1 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.804 0.442 . . . . 0.0 111.87 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -145.66 155.86 43.28 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.826 0.85 . . . . 0.0 109.984 -178.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.18 -34.97 74.33 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -75.09 -31.92 61.33 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 120.84 -1.162 . . . . 0.0 111.01 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.5 m -63.55 -40.59 97.39 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 122.095 -0.378 . . . . 0.0 110.025 169.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -58.28 -48.75 79.49 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.753 0.821 . . . . 0.0 110.104 172.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 11.1 mm -56.21 -53.63 37.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 123.472 0.709 . . . . 0.0 109.345 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.9 -39.05 96.39 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 118.822 0.737 . . . . 0.0 111.691 -176.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.61 -52.51 44.45 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.343 1.057 . . . . 0.0 110.451 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.5 mm -53.05 -47.32 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 C-N-CA 125.322 1.449 . . . . 0.0 108.791 176.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -66.96 -16.29 64.25 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.735 -0.603 . . . . 0.0 111.858 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -87.48 -46.38 9.65 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.695 0.798 . . . . 0.0 109.534 174.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.413 HD21 HD12 ' A' ' 103' ' ' LEU . 3.9 pp -71.17 -23.95 62.15 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.171 -178.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 63.0 m -59.5 -23.4 62.75 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.4 0.68 . . . . 0.0 112.11 172.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -64.62 -20.92 66.56 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.164 0.893 . . . . 0.0 110.25 173.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 31.0 mt -106.59 -60.71 1.63 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.631 1.572 . . . . 0.0 111.095 -178.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.24 -31.55 69.18 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.916 1.286 . . . . 0.0 113.622 -177.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 60.5 m -101.67 26.97 6.78 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 118.681 0.673 . . . . 0.0 110.832 -175.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -139.94 93.21 2.62 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -170.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.1 -27.0 41.83 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.949 0.9 . . . . 0.0 112.756 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.95 -45.55 91.95 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 122.882 0.473 . . . . 0.0 110.034 176.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.5 mp -68.16 -45.34 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.907 0.883 . . . . 0.0 108.817 175.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 73.0 mt -54.78 -42.69 72.06 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 118.753 -0.642 . . . . 0.0 111.291 -174.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -67.05 -40.87 87.19 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 118.407 0.549 . . . . 0.0 110.601 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.19 -33.99 74.23 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 118.71 0.687 . . . . 0.0 110.124 -176.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 23.4 mt -69.74 -53.37 18.72 Favored 'General case' 0 C--O 1.224 -0.239 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 170.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 31.4 mt -57.41 -21.05 33.92 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -176.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 82.6 p -114.21 8.53 16.88 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.539 1.136 . . . . 0.0 111.181 -177.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.92 125.32 22.56 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.206 1.002 . . . . 0.0 110.244 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.9 m -85.27 -10.1 56.9 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.119 0.968 . . . . 0.0 111.683 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 71.9 p -154.4 159.19 40.97 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.903 0.774 . . . . 0.0 110.451 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -59.16 -33.51 71.01 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.175 0.59 . . . . 0.0 109.644 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -57.75 -39.27 76.96 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 118.967 -0.539 . . . . 0.0 111.236 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -66.32 -44.4 83.48 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.806 0.73 . . . . 0.0 111.671 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.02 -50.28 71.3 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.769 0.713 . . . . 0.0 109.135 178.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.01 -32.6 66.31 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.912 1.285 . . . . 0.0 113.381 173.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.12 -43.26 82.87 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 119.877 1.217 . . . . 0.0 110.054 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 88.9 mt -64.91 -36.43 77.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 123.732 0.813 . . . . 0.0 109.587 178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 29.8 mm -58.51 -52.28 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 33.8 m -66.77 -26.41 66.95 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.754 0.422 . . . . 0.0 111.385 -171.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -57.69 -28.85 64.18 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.868 1.667 . . . . 0.0 113.001 173.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.933 0 N-CA-C 109.002 -1.639 . . . . 0.0 109.002 -174.765 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 tpt . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -66.79 109.21 2.8 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 169.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -52.24 -42.08 63.32 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.211 0.604 . . . . 0.0 110.05 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.61 -22.47 13.55 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.853 1.661 . . . . 0.0 113.485 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -65.71 -26.85 67.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.153 0.888 . . . . 0.0 112.094 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -96.71 -19.08 19.23 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.189 -170.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -97.7 112.72 62.22 Favored Pre-proline 0 CA--C 1.546 0.809 0 CA-C-N 120.864 1.665 . . . . 0.0 108.75 -173.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.69 -173.22 0.09 OUTLIER 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 125.236 3.957 . . . . 0.0 114.711 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -72.99 145.61 46.58 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 171.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.1 m 50.08 24.36 1.38 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.359 1.464 . . . . 0.0 112.428 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 p -74.49 -9.04 58.2 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.444 -0.785 . . . . 0.0 112.357 -172.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.4 mp -115.49 136.94 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 C-N-CA 126.634 1.973 . . . . 0.0 107.048 -170.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.7 m -144.76 156.22 43.94 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.714 1.206 . . . . 0.0 110.335 -177.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.6 t -129.66 144.55 37.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 174.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mt -143.29 150.09 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 126.294 1.838 . . . . 0.0 106.539 -170.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -74.93 -48.2 25.8 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.565 -0.709 . . . . 0.0 109.883 171.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -159.95 144.19 14.6 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.184 -1.413 . . . . 0.0 107.184 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.17 162.12 24.87 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 169.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.3 tppt? -59.37 -43.75 92.83 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.033 0.533 . . . . 0.0 110.554 178.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -167.17 -178.1 3.98 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 127.679 2.392 . . . . 0.0 107.758 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.5 p-90 -64.3 -32.7 74.41 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.498 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.4 mt-30 -59.31 -52.7 64.52 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.706 1.594 . . . . 0.0 107.381 172.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -60.05 -36.55 77.56 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 121.803 -0.56 . . . . 0.0 111.295 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.61 -30.14 71.16 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 118.833 -0.603 . . . . 0.0 111.09 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -69.09 -47.7 73.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 119.292 0.951 . . . . 0.0 108.548 172.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -55.68 -47.74 76.26 Favored 'General case' 0 C--O 1.227 -0.098 0 CA-C-N 118.315 0.507 . . . . 0.0 109.883 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -61.41 -33.59 73.96 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 117.928 -1.034 . . . . 0.0 111.974 174.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.1 m -64.83 -29.97 70.95 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 119.987 1.267 . . . . 0.0 112.428 175.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.6 mmm -115.95 -13.98 11.27 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -168.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -58.58 -33.85 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 120.299 1.409 . . . . 0.0 112.514 -169.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.7 p -65.78 -37.62 86.8 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.327 0.967 . . . . 0.0 110.652 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 77.7 mt -72.17 -37.81 69.26 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.587 0.755 . . . . 0.0 109.268 175.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.47 -44.23 96.1 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.685 0.675 . . . . 0.0 110.306 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -63.89 -45.09 90.91 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.878 1.271 . . . . 0.0 111.827 -176.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -80.44 12.52 2.96 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.282 1.033 . . . . 0.0 111.595 175.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.33 4.6 p30 43.54 43.21 4.46 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.821 2.049 . . . . 0.0 114.891 -176.263 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.412 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 35.9 m-85 -75.96 -17.15 59.84 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 167.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.5 pt -145.26 173.82 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.653 1.981 . . . . 0.0 109.271 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.6 m -114.66 163.03 16.0 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.164 1.786 . . . . 0.0 109.267 169.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.21 -32.82 72.59 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.308 -0.87 . . . . 0.0 113.047 -170.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -58.23 -30.89 66.87 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.83 -0.544 . . . . 0.0 111.729 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -59.06 -46.59 87.86 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.391 0.676 . . . . 0.0 110.38 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.8 mp -56.73 -48.37 81.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 123.612 0.765 . . . . 0.0 109.001 176.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.5 tp60 -69.29 -26.24 64.64 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.264 -0.874 . . . . 0.0 112.027 -176.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.2 -39.37 93.84 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.828 1.195 . . . . 0.0 111.508 173.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 53.3 mt -66.5 -46.42 86.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.498 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.5 mttt -62.09 -42.4 99.18 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -178.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.18 -38.61 91.68 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 124.009 0.924 . . . . 0.0 111.407 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 m -62.93 -40.54 97.92 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.815 -0.553 . . . . 0.0 110.187 172.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 26.1 m . . . . . 0 CA--C 1.542 0.636 0 C-N-CA 123.762 0.825 . . . . 0.0 111.17 174.444 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 . . . . . 0 N--CA 1.454 -0.229 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.4 mm -135.67 131.96 50.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 -173.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -124.55 -24.41 4.21 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 123.805 0.691 . . . . 0.0 110.918 -172.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.53 165.28 19.07 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 124.689 1.196 . . . . 0.0 108.112 170.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -49.35 126.94 16.79 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.338 2.025 . . . . 0.0 110.062 169.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.39 1.82 77.19 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-O 117.88 -1.511 . . . . 0.0 115.48 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 77.8 t -131.01 117.31 37.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-N 120.322 2.061 . . . . 0.0 108.355 -173.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.17 163.57 16.87 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.687 1.595 . . . . 0.0 109.917 -177.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.7 ttm -134.14 60.68 46.1 Favored Pre-proline 0 CA--C 1.545 0.751 0 CA-C-O 118.998 -0.525 . . . . 0.0 112.096 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -54.06 147.82 42.03 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.345 2.03 . . . . 0.0 113.293 -172.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 175.6 157.52 0.21 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 128.726 2.811 . . . . 0.0 106.542 -168.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.39 159.12 42.85 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 126.137 1.775 . . . . 0.0 107.931 169.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -51.21 143.34 17.52 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-O 118.3 -0.857 . . . . 0.0 109.322 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -47.91 -42.07 31.81 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.079 2.519 . . . . 0.0 113.017 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -62.22 -13.34 26.9 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.873 1.269 . . . . 0.0 114.05 -177.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 72.2 m -77.39 -6.12 52.21 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.636 0.774 . . . . 0.0 111.897 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 132.91 18.03 1.12 Allowed Glycine 0 CA--C 1.524 0.655 0 CA-C-O 118.206 -1.33 . . . . 0.0 113.315 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.45 148.13 49.99 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.792 1.796 . . . . 0.0 108.986 169.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.6 mt -127.66 -35.19 2.14 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 124.827 1.251 . . . . 0.0 110.501 -175.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.412 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 52.8 mttp -142.4 158.83 43.28 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 125.707 1.603 . . . . 0.0 107.916 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.1 m -91.15 125.17 35.85 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 123.157 0.583 . . . . 0.0 109.709 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -171.94 179.79 43.38 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.672 1.13 . . . . 0.0 110.966 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.627 ' SD ' HD21 ' A' ' 118' ' ' LEU . 56.7 mtt -143.23 167.95 20.92 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 125.453 1.501 . . . . 0.0 110.154 -172.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.4 p -148.57 167.53 25.16 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.926 1.291 . . . . 0.0 108.346 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.486 HD22 HD11 ' A' ' 144' ' ' ILE . 5.1 tp -142.75 124.71 15.22 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.609 -0.682 . . . . 0.0 109.77 -176.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 64.9 m -131.77 133.49 44.81 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.5 tp -126.44 139.11 53.5 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 173.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.3 mp -119.31 123.27 43.81 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 105.296 -2.112 . . . . 0.0 105.296 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.1 -41.26 92.18 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.666 0.667 . . . . 0.0 111.532 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 -90.69 -16.7 28.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.383 1.073 . . . . 0.0 111.724 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.21 178.86 9.1 Favored Glycine 0 CA--C 1.534 1.272 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -168.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.07 156.88 15.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 168.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -102.87 99.29 9.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.908 0.861 . . . . 0.0 112.189 -168.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 . . . . . 0 CA--C 1.539 0.525 0 CA-C-N 114.332 -1.304 . . . . 0.0 108.484 169.441 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo . . . . . 0 N--CA 1.459 -0.539 0 CA-C-O 120.788 0.245 . . . . 0.0 112.116 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 27.9 mm -69.47 111.41 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 175.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -82.94 -29.53 29.05 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 116.743 -1.599 . . . . 0.0 110.409 169.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.8 tp -132.68 139.94 47.9 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 121.174 1.806 . . . . 0.0 112.126 -173.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.0 mp -134.6 103.27 5.6 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -178.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.654 HG21 HD22 ' A' ' 118' ' ' LEU . 0.6 OUTLIER -83.17 118.1 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.142 0 N-CA-C 104.442 -2.429 . . . . 0.0 104.442 169.258 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.35 150.81 26.23 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 172.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.405 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -142.9 142.86 31.83 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 169.839 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.405 ' N ' HD23 ' A' ' 103' ' ' LEU . 16.3 m -142.85 143.52 32.13 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 169.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.46 139.08 29.7 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 -169.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.39 -23.26 43.39 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.153 0.581 . . . . 0.0 111.92 -176.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -145.48 156.63 43.85 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.172 0.989 . . . . 0.0 109.809 -178.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.77 -34.75 73.4 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.178 0.806 . . . . 0.0 113.178 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -75.78 -32.34 59.86 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 120.936 -1.103 . . . . 0.0 111.062 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.2 m -62.32 -42.01 99.01 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 169.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 35.5 t60 -57.92 -49.09 77.94 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.034 0.933 . . . . 0.0 110.211 173.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 8.9 mm -56.21 -54.77 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 118.869 0.759 . . . . 0.0 109.444 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.24 -38.48 94.61 Favored Glycine 0 CA--C 1.531 1.035 0 CA-C-N 118.664 0.666 . . . . 0.0 111.71 -176.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.78 -49.48 58.31 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.493 1.117 . . . . 0.0 110.816 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.9 mm -55.94 -43.05 73.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 124.448 1.099 . . . . 0.0 108.989 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.3 mm-40 -70.49 -12.88 61.86 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.461 0.704 . . . . 0.0 112.061 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.26 -43.67 14.62 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 170.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.654 HD22 HG21 ' A' ' 101' ' ' ILE . 96.3 mt -70.06 -27.71 64.86 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 121.864 -0.523 . . . . 0.0 111.759 -176.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 27.9 m -57.65 -21.87 42.39 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 171.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -74.89 -22.46 58.63 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.556 1.071 . . . . 0.0 111.058 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 49.2 mt -101.98 -62.22 1.29 Allowed 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 123.872 0.869 . . . . 0.0 110.639 -177.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.37 -13.24 58.16 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.402 1.481 . . . . 0.0 113.62 -173.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 37.3 m -117.81 29.86 7.59 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.039 0.836 . . . . 0.0 110.511 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -131.98 107.99 9.05 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 123.841 0.856 . . . . 0.0 109.035 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -55.96 -34.58 65.83 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.721 1.208 . . . . 0.0 110.454 -176.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -61.79 -44.84 96.08 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.242 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.35 -44.05 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 124.372 1.069 . . . . 0.0 109.351 177.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 7.0 mp -50.52 -45.24 56.56 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 119.123 0.874 . . . . 0.0 111.506 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -68.73 -37.09 79.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.829 0.74 . . . . 0.0 110.698 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -64.69 -40.49 95.48 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 118.969 0.804 . . . . 0.0 108.913 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.3 mt -69.12 -53.38 20.5 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.0 mt -61.44 -11.85 12.23 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.232 1.013 . . . . 0.0 113.575 -174.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 70.8 p -121.87 5.83 9.91 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.593 1.157 . . . . 0.0 111.661 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.63 119.58 7.86 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 124.58 1.152 . . . . 0.0 110.539 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -76.59 -15.6 59.8 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.186 0.994 . . . . 0.0 112.345 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.4 p -153.41 163.44 39.92 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 119.077 0.853 . . . . 0.0 111.502 -172.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 51.6 mp0 -59.09 -35.86 74.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.011 0.924 . . . . 0.0 109.18 169.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -59.15 -47.08 86.62 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 122.855 0.462 . . . . 0.0 110.96 175.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.57 -34.14 77.56 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.4 mt -66.34 -46.38 77.0 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.398 0.999 . . . . 0.0 109.276 174.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.11 -31.99 73.26 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.423 0.689 . . . . 0.0 112.445 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -58.59 -36.51 74.09 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.914 -1.116 . . . . 0.0 110.987 175.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 68.2 mt -71.74 -36.47 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 C-N-CA 124.083 0.953 . . . . 0.0 109.932 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . 0.486 HD11 HD22 ' A' ' 81' ' ' LEU . 50.7 mm -52.88 -52.5 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 24.8 m -69.23 -29.15 67.03 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.215 -171.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.0 ttm105 -70.07 -37.11 75.39 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 125.375 1.47 . . . . 0.0 110.628 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.166 -1.352 . . . . 0.0 111.229 177.971 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpp? . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -68.06 112.38 5.0 Favored 'General case' 0 C--N 1.341 0.225 0 N-CA-C 104.281 -2.488 . . . . 0.0 104.281 168.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -53.41 -39.01 63.98 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.321 0.648 . . . . 0.0 110.368 -175.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.7 p -53.4 -19.74 3.82 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.972 1.709 . . . . 0.0 114.066 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -60.86 -23.45 65.15 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.924 1.238 . . . . 0.0 112.706 175.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.61 -14.71 15.53 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -170.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -102.27 109.58 60.63 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 120.465 1.484 . . . . 0.0 108.079 -173.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -62.05 -70.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.042 2.495 . . . . 0.0 113.664 -173.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -163.15 -71.9 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.936 0.894 . . . . 0.0 111.637 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 m -69.86 6.4 1.21 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.69 1.196 . . . . 0.0 111.912 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -6.12 37.55 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.856 1.662 . . . . 0.0 113.593 -169.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.8 mt -122.75 130.14 74.69 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.787 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 -169.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.9 p -155.71 151.06 26.9 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.642 0.734 . . . . 0.0 111.914 -176.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.9 t -121.14 141.29 42.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 170.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.6 mt -136.58 145.99 29.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 C-N-CA 125.142 1.377 . . . . 0.0 108.214 -169.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -71.36 -38.43 71.58 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.807 -0.558 . . . . 0.0 111.699 175.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.9 p -174.33 148.15 1.23 Allowed 'General case' 0 C--O 1.237 0.403 0 N-CA-C 105.393 -2.077 . . . . 0.0 105.393 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.12 150.45 35.61 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 170.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.71 -41.55 81.98 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 176.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -157.61 169.65 24.19 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 126.78 2.032 . . . . 0.0 106.667 171.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -34.7 59.91 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.322 1.449 . . . . 0.0 112.718 169.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.465 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 26.2 mt-30 -60.64 -48.44 81.76 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.68 1.127 . . . . 0.0 109.383 170.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -63.5 -32.29 73.7 Favored 'General case' 0 C--O 1.223 -0.34 0 O-C-N 121.771 -0.581 . . . . 0.0 111.263 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.1 -36.29 83.09 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 121.833 -0.542 . . . . 0.0 110.059 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.99 -46.63 78.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 172.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -54.87 -45.85 74.67 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 121.751 -0.593 . . . . 0.0 110.697 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -65.32 -31.83 73.16 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 118.299 -0.858 . . . . 0.0 112.034 174.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.2 m -65.21 -20.3 66.37 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.618 1.099 . . . . 0.0 112.348 172.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.6 mmt -125.91 -20.02 4.7 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 114.919 1.452 . . . . 0.0 114.919 -168.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -60.03 -37.07 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 CA-C-N 120.714 1.597 . . . . 0.0 111.727 -169.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.3 m -65.39 -19.28 65.88 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.694 -0.629 . . . . 0.0 112.283 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 90.5 mt -91.36 -41.57 10.83 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.761 1.225 . . . . 0.0 109.144 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.6 tp -54.93 -42.68 72.55 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.007 0.923 . . . . 0.0 110.491 176.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -66.27 -28.33 68.63 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 125.312 1.445 . . . . 0.0 113.108 -173.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -99.54 18.52 17.71 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 118.241 0.473 . . . . 0.0 110.611 174.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.304 6.3 p30 46.72 38.43 5.81 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.539 1.536 . . . . 0.0 114.395 -171.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -68.42 -22.59 64.6 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.822 -1.174 . . . . 0.0 109.557 168.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.6 pt -143.43 177.24 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 126.446 1.898 . . . . 0.0 109.047 -176.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.8 m -117.16 157.46 25.91 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.603 1.961 . . . . 0.0 108.062 175.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.35 -31.79 70.65 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.026 -1.047 . . . . 0.0 112.94 -172.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -58.21 -33.24 69.08 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.887 -0.508 . . . . 0.0 111.878 175.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -60.09 -44.47 94.78 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.459 0.704 . . . . 0.0 110.494 -176.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -58.2 -50.94 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 174.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.0 tp60 -68.89 -26.17 64.98 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.412 -0.804 . . . . 0.0 112.058 -174.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.55 -43.64 89.39 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.493 1.042 . . . . 0.0 110.508 173.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 43.1 mt -68.3 -49.22 68.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.4 mttt -57.86 -42.51 84.63 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -61.35 -51.36 69.14 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.69 0.796 . . . . 0.0 111.242 -173.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 41.4 m -64.98 -39.9 94.16 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 118.306 0.503 . . . . 0.0 110.552 176.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 88.3 m . . . . . 0 CA--C 1.537 0.456 0 C-N-CA 122.964 0.506 . . . . 0.0 111.388 176.411 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 . . . . . 0 N--CA 1.456 -0.148 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 39.3 mm -136.22 136.01 49.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 104.919 -2.252 . . . . 0.0 104.919 -174.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -122.89 -30.65 3.78 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 123.215 0.606 . . . . 0.0 110.893 -170.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.57 157.94 27.08 Favored Pre-proline 0 N--CA 1.452 -0.343 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 173.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -51.99 120.02 6.56 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.026 1.818 . . . . 0.0 109.139 169.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 102.81 -15.68 55.31 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-O 117.942 -1.477 . . . . 0.0 114.117 -178.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 98.0 t -129.11 119.52 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 119.769 1.785 . . . . 0.0 109.538 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -116.49 166.85 11.61 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.689 1.596 . . . . 0.0 109.385 173.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 13.5 ttm -137.37 60.68 28.11 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.667 175.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -49.7 137.13 34.36 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 122.277 1.985 . . . . 0.0 113.98 -172.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -177.63 153.12 0.85 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 128.45 2.7 . . . . 0.0 106.706 -169.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.35 161.07 36.01 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 126.392 1.877 . . . . 0.0 107.459 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -53.63 143.14 39.68 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-O 117.651 -1.166 . . . . 0.0 108.876 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -46.83 -41.28 25.22 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.643 2.895 . . . . 0.0 113.246 -177.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -58.68 -14.72 9.17 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.601 1.56 . . . . 0.0 114.134 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 61.8 m -77.9 -4.61 47.62 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.66 0.784 . . . . 0.0 111.663 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 131.48 14.36 1.75 Allowed Glycine 0 C--N 1.337 0.597 0 CA-C-O 118.039 -1.423 . . . . 0.0 113.244 172.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.18 145.01 56.29 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 119.693 1.747 . . . . 0.0 109.289 169.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.5 mt -128.48 -34.82 2.0 Allowed 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.937 1.295 . . . . 0.0 110.291 -173.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -142.47 163.85 31.71 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 126.111 1.764 . . . . 0.0 108.026 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.1 m -97.49 130.79 44.54 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.187 0.595 . . . . 0.0 110.507 -176.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -173.74 179.48 45.09 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.742 1.163 . . . . 0.0 111.211 -176.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.633 ' SD ' HD21 ' A' ' 118' ' ' LEU . 56.4 mtt -144.89 167.85 21.64 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.168 1.387 . . . . 0.0 112.059 -172.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.3 m -138.33 166.16 24.91 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.076 1.75 . . . . 0.0 108.918 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.55 HD22 HD11 ' A' ' 144' ' ' ILE . 49.8 tp -147.85 85.47 1.55 Allowed 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.767 1.627 . . . . 0.0 108.025 -171.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.1 m -104.62 135.11 46.64 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.429 HD13 HD13 ' A' ' 99' ' ' LEU . 14.1 tp -129.58 142.62 50.71 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 173.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.6 mp -122.4 132.72 54.5 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.784 1.634 . . . . 0.0 106.795 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.0 -48.14 72.17 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 123.135 0.574 . . . . 0.0 110.237 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -90.43 -13.76 34.25 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.742 0.817 . . . . 0.0 112.317 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 64.31 -176.44 10.18 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 110.691 -0.963 . . . . 0.0 110.691 -168.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -148.53 167.8 3.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 169.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -120.3 96.6 5.21 Favored 'General case' 0 C--N 1.334 -0.079 0 O-C-N 121.643 -0.661 . . . . 0.0 110.699 -169.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.626 169.744 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 N--CA 1.459 -0.509 0 CA-C-O 121.808 0.67 . . . . 0.0 112.25 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 36.3 mm -111.04 136.34 47.4 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -177.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -108.74 -14.42 14.6 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 117.118 -1.42 . . . . 0.0 110.988 173.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.429 HD13 HD13 ' A' ' 83' ' ' LEU . 14.1 tp -139.3 136.25 34.67 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 120.854 1.661 . . . . 0.0 110.787 -175.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.6 mp -139.1 95.5 2.95 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 -172.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.665 HG21 HD22 ' A' ' 118' ' ' LEU . 1.7 mp -76.69 118.7 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 106.326 -1.731 . . . . 0.0 106.326 169.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -77.95 150.11 35.41 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 170.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.432 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -146.41 139.03 25.28 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 169.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.432 ' N ' HD23 ' A' ' 103' ' ' LEU . 4.0 m -142.5 144.93 33.2 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 169.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.16 138.96 25.57 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -170.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -78.9 -23.28 44.88 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.818 0.447 . . . . 0.0 111.982 -175.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -143.68 155.51 44.25 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.838 0.855 . . . . 0.0 109.825 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.93 -35.66 73.47 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.648 0.779 . . . . 0.0 113.013 -177.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -76.14 -32.32 59.05 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.059 -1.026 . . . . 0.0 111.173 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.9 m -62.31 -41.57 98.63 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 169.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -57.88 -50.03 74.7 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.229 1.011 . . . . 0.0 110.056 172.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.0 mm -56.16 -54.34 28.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 118.709 0.686 . . . . 0.0 109.412 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.41 -39.4 96.18 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-N 118.775 0.716 . . . . 0.0 111.561 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.54 -49.62 62.45 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.183 0.993 . . . . 0.0 110.819 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.5 mm -55.63 -44.01 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.548 1.139 . . . . 0.0 108.974 176.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -70.72 -12.39 61.53 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.54 0.736 . . . . 0.0 112.032 -178.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.51 -45.21 13.83 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 170.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.665 HD22 HG21 ' A' ' 101' ' ' ILE . 94.7 mt -69.84 -28.64 65.85 Favored 'General case' 0 CA--C 1.515 -0.371 0 O-C-N 121.919 -0.488 . . . . 0.0 111.732 -176.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.0 m -60.91 -20.76 62.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.241 0.616 . . . . 0.0 112.33 171.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -71.6 -22.57 61.7 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.672 1.124 . . . . 0.0 110.4 174.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 45.4 mt -103.3 -64.67 1.06 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.157 0.983 . . . . 0.0 110.284 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.402 HD11 ' HB ' ' A' ' 101' ' ' ILE . 19.2 mt -73.46 1.21 10.29 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -170.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.0 m -121.73 27.78 7.99 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.118 0.967 . . . . 0.0 110.954 174.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -139.4 95.96 3.02 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 -170.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.2 -25.53 33.51 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.131 0.972 . . . . 0.0 112.618 -172.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -63.51 -44.18 95.05 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 123.064 0.546 . . . . 0.0 110.076 175.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.3 -40.82 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 C-N-CA 125.087 1.355 . . . . 0.0 109.887 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 6.8 mp -51.41 -43.39 61.95 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 119.712 1.142 . . . . 0.0 111.678 -178.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -69.93 -36.81 75.61 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.75 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -63.76 -41.55 97.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 119.107 0.867 . . . . 0.0 108.831 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 6.8 mt -67.17 -52.93 35.34 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 60.9 mt -62.38 -14.68 42.69 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 63.5 p -116.87 5.48 12.99 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.391 1.076 . . . . 0.0 111.83 178.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.38 115.74 3.46 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.14 0.976 . . . . 0.0 109.37 177.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.5 m -87.96 -4.79 58.78 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.206 1.002 . . . . 0.0 111.933 -177.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.6 p -152.84 163.08 40.42 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.547 0.739 . . . . 0.0 110.08 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 58.8 mp0 -58.32 -37.64 75.52 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 123.943 0.897 . . . . 0.0 109.819 169.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -58.05 -45.97 86.17 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-O 119.359 -0.353 . . . . 0.0 110.356 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -65.38 -26.55 68.05 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 118.608 -0.71 . . . . 0.0 112.905 177.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 49.5 mt -72.69 -48.29 40.19 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 120.305 1.412 . . . . 0.0 109.0 172.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.09 -26.84 69.02 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 177.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -58.73 -37.97 77.34 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.007 -1.058 . . . . 0.0 110.607 172.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 67.6 mt -74.29 -36.26 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 124.018 0.927 . . . . 0.0 109.512 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . 0.55 HD11 HD22 ' A' ' 81' ' ' LEU . 33.3 mm -55.16 -48.93 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 169.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.2 m -67.91 -26.62 66.07 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.367 -171.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 23.7 ttm105 -79.27 -16.03 57.06 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 126.852 2.061 . . . . 0.0 111.728 177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.91 0 N-CA-C 108.688 -1.765 . . . . 0.0 108.688 174.569 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tpt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.564 0.221 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -65.47 116.9 7.23 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.54 HD23 ' HA3' ' A' ' 147' ' ' GLY . 4.0 mm? -59.15 -39.05 81.23 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.651 0.78 . . . . 0.0 110.023 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.9 p -59.55 -14.97 15.2 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 124.937 1.295 . . . . 0.0 112.025 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -84.0 -27.14 28.63 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 123.951 0.901 . . . . 0.0 113.404 174.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -96.95 -39.01 9.58 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 122.889 0.476 . . . . 0.0 111.393 -174.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.43 ' CE2' HD11 ' A' ' 12' ' ' ILE . 0.1 OUTLIER -89.03 127.02 57.22 Favored Pre-proline 0 CA--C 1.551 0.997 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -173.519 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -69.44 -76.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 122.552 2.168 . . . . 0.0 113.131 -170.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' A' ' 11' ' ' SER . 32.1 tt0 -166.39 -62.08 0.03 OUTLIER 'General case' 0 C--O 1.231 0.107 0 C-N-CA 125.317 1.447 . . . . 0.0 109.886 -177.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.04 11.75 0.28 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.93 1.692 . . . . 0.0 112.149 175.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.422 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -68.87 -23.33 64.2 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 126.938 2.095 . . . . 0.0 111.429 -169.642 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.447 HG13 ' HB2' ' A' ' 141' ' ' ALA . 13.6 mm -98.99 139.34 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.298 0 C-N-CA 124.604 1.161 . . . . 0.0 108.016 -169.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 m -158.91 128.46 5.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 118.398 0.545 . . . . 0.0 109.857 169.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 p -96.74 142.94 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 105.613 -1.995 . . . . 0.0 105.613 168.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 15' ' ' ILE . 21.4 mt -138.31 148.61 24.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 -169.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -65.72 -48.72 71.01 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.451 -0.781 . . . . 0.0 110.309 169.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -169.67 148.46 3.66 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 105.334 -2.099 . . . . 0.0 105.334 -178.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.34 153.47 42.33 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 171.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -54.49 -43.23 71.61 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.381 0.673 . . . . 0.0 110.093 173.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -163.58 177.07 9.08 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 126.938 2.095 . . . . 0.0 107.765 169.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -54.81 -36.39 64.91 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 126.285 1.834 . . . . 0.0 113.937 175.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.408 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.8 mt-30 -62.52 -49.79 73.94 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 120.328 1.422 . . . . 0.0 108.459 171.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -60.65 -31.46 70.68 Favored 'General case' 0 C--O 1.222 -0.362 0 O-C-N 122.067 -0.396 . . . . 0.0 111.833 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.57 83.17 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.473 -0.767 . . . . 0.0 110.221 -178.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.3 -45.06 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 169.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -57.4 -46.56 83.33 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 122.959 0.503 . . . . 0.0 110.163 -176.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -63.43 -36.15 82.78 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.976 1.31 . . . . 0.0 111.771 172.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.5 m -62.66 -21.38 65.67 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.636 1.107 . . . . 0.0 112.504 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.7 mmt -122.43 -18.82 6.6 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -169.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.7 p -60.88 -35.92 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 121.152 1.796 . . . . 0.0 111.74 -171.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -67.16 -21.58 65.8 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.968 0.804 . . . . 0.0 111.998 179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.8 mt -83.41 -43.97 15.31 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.166 0.986 . . . . 0.0 108.658 171.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 34.2 tp -57.19 -42.85 82.01 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.331 1.052 . . . . 0.0 111.038 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.91 -30.14 67.6 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 126.271 1.829 . . . . 0.0 113.256 -176.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -108.93 20.73 18.11 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.377 0.0 OUTLIER 42.4 38.48 1.22 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.379 2.272 . . . . 0.0 115.38 -172.533 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -66.19 -21.18 66.31 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.416 -0.802 . . . . 0.0 110.081 168.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.1 pt -149.05 175.91 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 127.074 2.15 . . . . 0.0 108.488 -173.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.5 p -113.58 166.33 11.63 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.458 1.503 . . . . 0.0 108.486 169.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.46 -28.16 69.78 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.023 -1.048 . . . . 0.0 111.327 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -61.49 -38.08 86.0 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 121.679 -0.638 . . . . 0.0 111.301 176.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -57.11 -48.0 79.7 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.607 0.763 . . . . 0.0 109.85 178.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.0 mt -59.04 -50.39 79.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 124.99 1.316 . . . . 0.0 109.04 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -68.05 -27.34 66.43 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.954 -174.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.96 -43.38 86.42 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.4 1.0 . . . . 0.0 110.651 172.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 18.3 mt -68.06 -49.39 68.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.408 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 86.3 mttt -60.24 -47.09 87.46 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -174.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.64 -44.17 94.63 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.607 0.763 . . . . 0.0 110.923 -175.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.6 m -63.01 -44.5 95.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.989 0.516 . . . . 0.0 110.02 175.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.9 m . . . . . 0 CA--C 1.537 0.453 0 C-N-CA 123.759 0.824 . . . . 0.0 111.516 176.496 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 . . . . . 0 N--CA 1.454 -0.241 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 50.1 mm -128.58 143.64 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 105.494 -2.039 . . . . 0.0 105.494 -177.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 mp -132.02 -31.51 1.48 Allowed 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -169.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -163.53 163.45 16.38 Favored Pre-proline 0 C--O 1.236 0.351 0 C-N-CA 124.881 1.272 . . . . 0.0 107.596 -175.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.25 112.01 0.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.25 2.633 . . . . 0.0 111.846 171.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.17 4.69 77.54 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-O 117.471 -1.738 . . . . 0.0 114.618 176.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.49 126.89 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 119.977 1.889 . . . . 0.0 109.572 -169.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.76 171.01 12.11 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 125.879 1.672 . . . . 0.0 109.875 177.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.587 ' HE2' HD12 ' A' ' 122' ' ' LEU . 9.1 ttm -146.72 66.17 10.53 Favored Pre-proline 0 CA--C 1.54 0.578 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -50.67 137.05 42.08 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 121.178 1.252 . . . . 0.0 112.972 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -177.56 155.75 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 129.776 3.23 . . . . 0.0 105.279 -170.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.11 163.44 30.81 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.557 1.143 . . . . 0.0 108.336 171.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -52.11 139.08 35.22 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-O 118.024 -0.988 . . . . 0.0 109.413 175.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -44.67 -47.91 10.98 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.961 3.107 . . . . 0.0 113.335 -177.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -69.11 -4.26 16.56 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -175.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 73.7 m -78.94 -4.32 49.27 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.233 -0.917 . . . . 0.0 111.976 172.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 136.62 13.64 0.96 Allowed Glycine 0 CA--C 1.526 0.747 0 CA-C-N 119.485 1.039 . . . . 0.0 114.135 174.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.73 147.74 52.23 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 119.566 1.683 . . . . 0.0 108.804 169.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.2 mt -131.23 -31.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.65 1.18 . . . . 0.0 110.197 -175.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -144.91 154.61 42.79 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.311 1.444 . . . . 0.0 108.522 175.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 37.5 m -86.64 129.68 34.78 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 123.394 0.678 . . . . 0.0 109.886 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.23 -175.75 38.72 Favored Glycine 0 CA--C 1.527 0.808 0 C-N-CA 123.816 0.722 . . . . 0.0 111.313 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 49.5 mtp -145.09 170.14 16.77 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.242 1.417 . . . . 0.0 110.844 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 33.0 m -157.27 173.34 17.09 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.165 1.786 . . . . 0.0 108.701 170.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.3 tp -148.21 116.45 6.51 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.071 1.348 . . . . 0.0 110.904 -168.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 87.8 m -118.37 143.68 46.47 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 125.081 1.352 . . . . 0.0 108.746 -177.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -134.85 143.44 47.01 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 171.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.4 mp -121.72 133.08 54.94 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.124 1.77 . . . . 0.0 106.313 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -67.14 -48.04 69.24 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.793 -0.567 . . . . 0.0 110.913 177.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -88.1 -15.95 34.83 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.555 0.742 . . . . 0.0 112.001 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.92 -178.21 21.27 Favored Glycine 0 CA--C 1.532 1.1 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -168.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -145.32 167.57 9.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 169.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -121.5 93.35 3.98 Favored 'General case' 0 C--N 1.333 -0.12 0 O-C-N 121.805 -0.56 . . . . 0.0 110.799 -169.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 . . . . . 0 CA--C 1.538 0.515 0 C-N-CA 123.743 0.817 . . . . 0.0 110.616 169.96 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo . . . . . 0 CA--C 1.534 0.52 0 CA-C-O 121.401 0.501 . . . . 0.0 111.7 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.7 mm -113.49 138.32 43.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 21.3 mtpp -112.05 -19.63 12.25 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 117.291 -1.338 . . . . 0.0 111.03 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.6 tp -133.66 131.71 39.85 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 120.218 1.372 . . . . 0.0 109.424 -170.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.6 mp -138.4 135.1 34.94 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -175.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.438 ' HB ' HD11 ' A' ' 122' ' ' LEU . 2.0 mt -113.12 127.84 70.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 169.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.22 145.89 25.91 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 107.634 -2.186 . . . . 0.0 107.634 169.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.402 HD12 HD23 ' A' ' 118' ' ' LEU . 6.9 tt -143.62 132.6 22.84 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 169.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 85.3 p -124.39 153.39 41.94 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 169.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -152.87 133.06 13.51 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 118.343 0.52 . . . . 0.0 110.189 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.24 -22.06 58.16 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.024 0.53 . . . . 0.0 111.938 177.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -148.65 156.32 42.24 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.311 1.044 . . . . 0.0 109.642 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.41 -34.49 72.53 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -177.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.64 -30.94 61.8 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 120.749 -1.219 . . . . 0.0 111.065 177.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.1 m -67.16 -37.1 83.19 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.632 -0.668 . . . . 0.0 110.342 171.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -59.04 -49.02 79.48 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 123.857 0.863 . . . . 0.0 109.585 170.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 14.7 mm -54.29 -49.62 62.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 176.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.16 -42.79 97.32 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-N 119.199 0.908 . . . . 0.0 112.478 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.42 -40.47 67.09 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.398 0.679 . . . . 0.0 111.199 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.455 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 8.4 mm -58.03 -47.0 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 C-N-CA 125.391 1.477 . . . . 0.0 107.501 173.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -67.74 0.15 3.55 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.347 1.459 . . . . 0.0 112.661 178.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -100.3 -54.76 2.78 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 124.824 1.25 . . . . 0.0 107.868 169.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.457 HD12 ' N ' ' A' ' 119' ' ' SER . 1.4 pp -64.43 -21.68 66.72 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -178.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . 0.457 ' N ' HD12 ' A' ' 118' ' ' LEU . 54.5 p -59.39 -30.39 68.41 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 123.62 0.768 . . . . 0.0 111.844 175.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -70.14 -11.15 60.68 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.545 -0.722 . . . . 0.0 110.975 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.517 ' HA ' HG21 ' A' ' 127' ' ' ILE . 35.2 mt -110.64 -63.62 1.37 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.115 0.966 . . . . 0.0 111.008 176.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.587 HD12 ' HE2' ' A' ' 65' ' ' MET . 17.1 mt -70.6 -17.3 62.9 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -172.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.1 m -111.85 27.78 9.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.597 0.759 . . . . 0.0 110.402 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -132.8 97.7 4.11 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 107.227 -1.397 . . . . 0.0 107.227 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -57.85 -28.33 64.02 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.232 -175.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -67.27 -42.55 83.68 Favored 'General case' 0 C--O 1.23 0.072 0 CA-C-O 121.303 0.573 . . . . 0.0 109.772 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.517 HG21 ' HA ' ' A' ' 121' ' ' LEU . 1.2 mp -69.05 -42.94 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.484 HD21 ' HA ' ' A' ' 122' ' ' LEU . 40.2 mt -54.09 -44.98 71.66 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 118.893 -0.575 . . . . 0.0 111.061 -175.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -69.7 -34.99 74.69 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 118.244 0.475 . . . . 0.0 110.109 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -72.28 -35.22 68.66 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.946 0.794 . . . . 0.0 109.883 -177.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 28.9 mt -67.28 -52.15 44.16 Favored 'General case' 0 C--O 1.225 -0.203 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 170.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.4 -24.66 56.79 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 66.9 p -105.46 5.33 31.49 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.737 1.215 . . . . 0.0 112.122 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -56.5 116.45 3.11 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 119.181 0.9 . . . . 0.0 110.413 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.3 m -68.63 -29.39 67.88 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 125.354 1.462 . . . . 0.0 111.342 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 33.1 m -147.68 164.33 33.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.971 1.309 . . . . 0.0 109.855 -169.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -54.6 -39.08 67.49 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.14 1.376 . . . . 0.0 110.389 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -56.08 -39.89 72.8 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.939 0.896 . . . . 0.0 112.389 -176.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -61.45 -43.99 97.89 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 118.824 0.738 . . . . 0.0 110.851 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.6 mt -62.87 -49.54 74.43 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -178.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.447 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -60.05 -27.89 67.33 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 174.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -81.24 -39.43 25.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 119.05 0.841 . . . . 0.0 110.6 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 63.4 mt -66.95 -33.0 60.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 123.958 0.903 . . . . 0.0 109.253 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 1.1 mm -48.37 -47.77 14.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.75 1.22 . . . . 0.0 111.287 169.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 16.3 m -66.18 -18.61 65.45 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.789 0.836 . . . . 0.0 112.562 -169.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 32.1 ttp85 -53.82 -35.67 61.68 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.696 1.198 . . . . 0.0 112.93 173.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . 0.54 ' HA3' HD23 ' A' ' 3' ' ' LEU . . . . . . . . 0 C--O 1.247 0.953 0 N-CA-C 107.876 -2.09 . . . . 0.0 107.876 -173.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.872 0.367 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.44 ' HD2' ' HA ' ' A' ' 2' ' ' ARG . 6.3 mmm180 -68.12 114.18 6.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.164 -175.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.0 -34.35 74.67 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.754 175.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.1 m -55.16 -15.92 2.68 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.0 0.818 . . . . 0.0 113.079 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -62.38 -23.32 66.74 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 172.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -106.5 -19.1 13.78 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -169.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -105.58 100.46 26.79 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 120.657 1.571 . . . . 0.0 107.589 -169.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -59.51 -67.41 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.462 2.775 . . . . 0.0 114.135 -170.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -162.26 -72.98 0.05 Allowed 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 123.78 0.832 . . . . 0.0 111.485 -174.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.7 m -67.75 2.6 1.83 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.559 1.144 . . . . 0.0 112.009 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.52 -14.84 63.28 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.825 1.65 . . . . 0.0 112.745 -169.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.4 mt -117.8 130.35 72.81 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 105.123 -2.177 . . . . 0.0 105.123 -169.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 75.8 m -156.9 149.38 23.31 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.51 0.671 . . . . 0.0 111.231 -177.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.4 t -117.96 141.38 37.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 105.632 -1.988 . . . . 0.0 105.632 169.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.2 mt -135.37 145.01 32.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 125.602 1.561 . . . . 0.0 107.767 -169.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -68.19 -36.3 79.37 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.878 -0.514 . . . . 0.0 111.909 176.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 p -179.54 146.61 0.28 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.802 2.041 . . . . 0.0 106.346 -177.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.79 154.12 36.47 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 169.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.53 -42.94 83.89 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.215 0.606 . . . . 0.0 109.778 174.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -166.07 177.88 6.72 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 128.34 2.656 . . . . 0.0 107.29 172.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.46 -37.49 65.27 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 126.352 1.861 . . . . 0.0 114.015 175.354 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.446 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.1 mt-30 -62.03 -50.4 72.17 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.316 1.416 . . . . 0.0 108.364 172.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -60.04 -31.33 69.86 Favored 'General case' 0 C--O 1.222 -0.348 0 O-C-N 122.039 -0.413 . . . . 0.0 111.808 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.24 -38.01 84.48 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.582 -0.699 . . . . 0.0 110.234 -179.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.9 -45.35 91.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 169.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -56.69 -44.87 81.92 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 122.696 0.398 . . . . 0.0 110.208 -176.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -69.42 -28.29 66.01 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.758 1.223 . . . . 0.0 112.466 174.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m -64.71 -20.94 66.61 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.953 1.251 . . . . 0.0 111.53 170.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.4 mmt -122.69 -21.47 5.63 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -169.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -59.26 -35.27 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 120.944 1.702 . . . . 0.0 112.16 -169.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.5 m -64.43 -30.97 72.0 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.039 0.836 . . . . 0.0 111.417 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.7 mt -77.41 -43.22 33.33 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.807 0.843 . . . . 0.0 108.821 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 28.3 tp -56.67 -41.42 77.22 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.825 0.85 . . . . 0.0 110.956 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.61 -29.1 68.35 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 124.992 1.317 . . . . 0.0 112.78 -171.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -99.71 16.45 23.49 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.09 0.405 . . . . 0.0 110.654 172.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.336 3.4 p30 44.9 46.54 9.02 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.969 1.708 . . . . 0.0 114.167 -171.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -72.73 -19.96 61.29 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.596 -0.69 . . . . 0.0 109.14 167.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 pt -142.36 172.99 7.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 127.242 2.217 . . . . 0.0 108.531 -178.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m -108.23 159.03 16.94 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.165 1.786 . . . . 0.0 108.195 170.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -60.75 -33.72 73.36 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.86 -1.15 . . . . 0.0 111.74 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -62.34 -25.63 68.0 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.273 -0.892 . . . . 0.0 113.091 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -63.3 -45.73 90.01 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 119.521 1.055 . . . . 0.0 109.591 174.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.7 mt -59.9 -51.26 74.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 124.75 1.22 . . . . 0.0 108.816 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -68.75 -24.54 64.46 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.718 -174.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.5 -42.52 82.92 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.661 1.119 . . . . 0.0 110.765 172.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 14.9 mt -69.86 -49.22 58.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.446 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.8 mttt -59.81 -42.16 92.83 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -174.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -60.42 -48.07 83.37 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.734 0.814 . . . . 0.0 111.532 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.6 m -62.55 -43.32 99.1 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.309 0.504 . . . . 0.0 110.456 176.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 42.1 m . . . . . 0 CA--C 1.541 0.613 0 C-N-CA 123.527 0.731 . . . . 0.0 111.29 178.397 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 C--O 1.225 -0.208 0 N-CA-C 109.311 -0.625 . . . . 0.0 109.311 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.5 mm -118.02 138.71 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -124.18 -33.36 3.09 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.255 0.622 . . . . 0.0 112.183 -169.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.51 164.19 20.0 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 124.844 1.258 . . . . 0.0 107.794 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -46.32 112.72 0.5 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.412 2.741 . . . . 0.0 111.997 172.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.41 5.38 85.04 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-O 117.792 -1.56 . . . . 0.0 114.677 176.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.9 t -127.26 122.92 60.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 120.066 1.933 . . . . 0.0 108.896 -169.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.71 171.1 10.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.802 1.641 . . . . 0.0 109.998 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.492 ' CE ' HD11 ' A' ' 118' ' ' LEU . 9.1 ttm -141.31 58.76 9.31 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 123.997 0.919 . . . . 0.0 111.516 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -56.32 128.12 28.83 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 121.807 1.671 . . . . 0.0 110.535 -176.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -179.11 162.69 1.24 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 127.809 2.444 . . . . 0.0 106.719 -169.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.83 171.79 13.91 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.791 1.237 . . . . 0.0 109.237 -175.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 -57.71 154.09 27.94 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-O 118.375 -0.822 . . . . 0.0 109.632 171.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.38 -40.17 83.74 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.499 2.132 . . . . 0.0 109.488 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.67 -16.97 30.29 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.948 2.099 . . . . 0.0 113.179 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 84.2 m -77.1 -9.41 58.72 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.736 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 135.78 17.26 0.84 Allowed Glycine 0 C--N 1.34 0.775 0 CA-C-O 118.234 -1.315 . . . . 0.0 113.859 175.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 148.42 51.78 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.435 1.617 . . . . 0.0 109.358 172.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.8 mt -129.24 -33.98 1.89 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 124.459 1.103 . . . . 0.0 110.685 -175.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -146.7 159.78 43.04 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.267 1.427 . . . . 0.0 108.524 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 85.2 m -92.47 125.47 37.13 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 123.379 0.672 . . . . 0.0 111.986 -175.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.62 -178.5 42.77 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 125.104 1.335 . . . . 0.0 111.294 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 13.1 mtm -147.36 169.79 18.71 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.962 1.705 . . . . 0.0 111.778 -176.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -136.88 161.02 37.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.503 1.921 . . . . 0.0 108.829 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 33.4 tp -143.03 106.28 4.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.818 2.047 . . . . 0.0 108.122 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.1 m -121.41 136.21 54.98 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -170.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tt -132.99 136.57 46.13 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 119.348 0.977 . . . . 0.0 108.404 175.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.0 mp -113.95 126.74 55.49 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 125.54 1.536 . . . . 0.0 107.311 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -61.78 -40.77 96.33 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.323 0.649 . . . . 0.0 110.892 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -96.35 -10.75 27.03 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.829 0.851 . . . . 0.0 112.175 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 61.3 -173.74 6.53 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -169.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -150.27 168.27 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 168.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -125.94 92.42 3.59 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 121.5 0.666 . . . . 0.0 110.203 -170.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 . . . . . 0 CA--C 1.537 0.45 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.337 171.516 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo . . . . . 0 N--CA 1.459 -0.504 0 CA-C-O 121.241 0.434 . . . . 0.0 111.453 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.0 mm -113.55 137.4 46.79 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -114.01 -15.13 12.35 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 116.519 -1.705 . . . . 0.0 111.146 175.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.514 HD13 HD13 ' A' ' 131' ' ' LEU . 0.6 OUTLIER -138.73 144.06 39.33 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 121.249 1.841 . . . . 0.0 111.982 175.171 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -139.37 109.79 6.57 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.654 1.582 . . . . 0.0 107.386 -173.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.457 ' HB ' HD11 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -84.9 135.6 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 168.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -97.88 154.81 20.32 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 109.218 -1.553 . . . . 0.0 109.218 170.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.519 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -152.11 144.54 24.1 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 173.511 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.519 ' N ' HD23 ' A' ' 103' ' ' LEU . 82.5 p -142.53 145.05 33.23 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 168.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.643 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -144.1 146.91 33.11 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 119.27 0.941 . . . . 0.0 109.642 169.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.01 -14.56 59.12 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.483 -176.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -136.97 151.0 48.51 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.436 0.694 . . . . 0.0 110.202 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.43 -35.38 77.4 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -72.6 -30.39 64.32 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 121.139 -0.976 . . . . 0.0 110.917 176.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.43 ' HB2' ' HB1' ' A' ' 105' ' ' ALA . 19.6 m -66.46 -36.45 82.81 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.383 169.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.643 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 27.3 m-70 -61.55 -45.79 92.66 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 119.303 0.956 . . . . 0.0 109.969 170.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 20.8 mm -55.7 -51.76 55.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 118.985 0.811 . . . . 0.0 109.274 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.26 -41.8 96.97 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-N 118.854 0.752 . . . . 0.0 111.669 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.37 -43.68 73.08 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.492 0.717 . . . . 0.0 111.22 -179.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.8 mm -59.11 -46.47 91.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 C-N-CA 124.847 1.259 . . . . 0.0 108.282 175.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -68.03 -12.05 60.1 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.352 -0.843 . . . . 0.0 111.562 -178.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -91.52 -50.16 5.93 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 124.216 1.006 . . . . 0.0 109.089 173.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.492 HD11 ' CE ' ' A' ' 65' ' ' MET . 4.2 pp -69.01 -26.81 65.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 121.69 -0.631 . . . . 0.0 111.478 -176.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.8 m -62.16 -22.18 65.66 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 119.118 -0.467 . . . . 0.0 112.168 173.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -65.97 -16.7 64.12 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.396 0.998 . . . . 0.0 110.336 172.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 34.1 mt -106.3 -60.91 1.59 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.612 1.565 . . . . 0.0 110.115 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.488 HD12 ' HE2' ' A' ' 65' ' ' MET . 13.6 mt -69.15 -17.51 63.83 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -173.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 44.3 m -113.03 27.38 9.67 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 119.046 0.839 . . . . 0.0 110.595 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -139.31 96.87 3.17 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 -170.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.44 -25.77 38.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.296 1.038 . . . . 0.0 112.737 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.34 -45.8 89.54 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.373 0.606 . . . . 0.0 109.896 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -72.15 -38.21 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.3 mt -59.06 -33.37 70.71 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 119.312 0.96 . . . . 0.0 111.468 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -68.27 -43.34 78.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 120.858 -1.151 . . . . 0.0 110.334 172.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -64.73 -33.36 75.78 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.599 0.636 . . . . 0.0 110.665 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.514 HD13 HD13 ' A' ' 99' ' ' LEU . 2.6 pp -78.11 -45.41 23.44 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.119 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 53.8 mt -62.97 -24.03 67.7 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 120.225 1.375 . . . . 0.0 112.395 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 52.4 p -94.36 1.0 55.89 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.984 0.914 . . . . 0.0 111.646 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.96 107.67 2.76 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.131 0.878 . . . . 0.0 110.944 -176.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.2 p -77.42 -24.24 50.47 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.776 1.23 . . . . 0.0 112.208 176.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 29.8 m -147.55 157.47 43.57 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.86 0.864 . . . . 0.0 111.32 -169.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -50.04 -42.25 49.22 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.963 2.105 . . . . 0.0 111.643 177.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -70.57 -21.97 62.63 Favored 'General case' 0 CA--C 1.527 0.081 0 O-C-N 121.452 -0.78 . . . . 0.0 112.559 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -76.42 -32.2 58.36 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 120.163 1.347 . . . . 0.0 109.468 173.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.48 -43.42 76.99 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.269 -0.894 . . . . 0.0 108.642 174.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -56.44 -38.93 72.29 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 170.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.18 -39.01 91.29 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 119.154 0.888 . . . . 0.0 111.191 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 86.4 mt -62.03 -43.48 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.453 0.701 . . . . 0.0 109.578 175.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 18.0 mm -58.92 -43.56 88.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 C-N-CA 122.792 0.437 . . . . 0.0 110.299 176.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 52.3 m -72.67 -26.75 61.74 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 122.017 -0.427 . . . . 0.0 111.831 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 -70.06 -40.43 75.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.305 1.042 . . . . 0.0 110.049 174.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 C-N-CA 124.639 1.114 . . . . 0.0 110.477 -174.623 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 N--CA 1.485 1.312 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -62.31 113.08 2.7 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 168.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -53.49 -43.34 68.16 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.146 0.978 . . . . 0.0 108.794 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -54.05 -21.62 8.81 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.158 1.383 . . . . 0.0 113.69 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.99 -26.12 68.03 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.73 1.15 . . . . 0.0 112.659 173.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -97.85 -22.33 16.42 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 118.132 -0.937 . . . . 0.0 113.377 -171.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -104.04 101.16 24.11 Favored Pre-proline 0 N--CA 1.473 0.702 0 N-CA-C 105.342 -2.096 . . . . 0.0 105.342 -173.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.01 -77.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.075 2.517 . . . . 0.0 113.344 -169.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -159.54 160.09 34.12 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 127.146 2.178 . . . . 0.0 105.696 174.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 m 60.47 1.4 0.39 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.587 1.555 . . . . 0.0 112.99 -177.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.26 -7.63 55.32 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 127.543 2.337 . . . . 0.0 112.766 -169.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.5 mt -120.42 129.41 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.935 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -169.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.7 p -147.67 146.88 29.47 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.495 0.664 . . . . 0.0 112.093 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 93.7 t -127.47 136.52 60.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 171.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.0 mt -139.56 150.73 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 125.981 1.713 . . . . 0.0 106.906 -169.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 55.3 t60 -75.3 -48.78 21.6 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.838 -0.539 . . . . 0.0 109.718 172.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.1 p -157.27 150.15 23.45 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 178.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.68 156.04 26.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 170.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -59.59 -31.21 69.26 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.161 175.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -166.37 173.7 9.75 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 126.844 2.057 . . . . 0.0 107.704 177.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 1.2 p90 -64.12 -33.44 75.77 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 123.747 0.819 . . . . 0.0 111.501 169.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.423 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.5 mt-30 -59.23 -48.83 80.16 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 169.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.34 -30.89 71.78 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 122.048 -0.408 . . . . 0.0 111.438 -179.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.96 -36.8 83.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.529 -0.732 . . . . 0.0 110.026 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.32 -45.64 92.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 169.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -56.65 -45.92 81.35 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.766 0.427 . . . . 0.0 110.296 -177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -67.14 -31.04 71.21 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.872 1.269 . . . . 0.0 112.172 174.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.1 m -64.61 -21.81 66.81 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.875 1.216 . . . . 0.0 111.979 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.6 mmt -123.36 -20.48 5.61 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -169.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -60.99 -34.18 58.78 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-N 121.03 1.741 . . . . 0.0 111.595 -171.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.0 m -62.35 -26.44 68.45 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.778 0.717 . . . . 0.0 111.755 178.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.0 mt -84.83 -40.97 16.52 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.105 0.962 . . . . 0.0 109.179 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.3 tp -56.4 -40.92 75.44 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.775 0.83 . . . . 0.0 110.828 178.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -66.62 -25.44 66.6 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 125.827 1.651 . . . . 0.0 113.788 -171.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -110.82 23.62 13.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.768 0.427 . . . . 0.0 110.019 172.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.305 3.7 p30 45.39 43.06 8.2 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.483 1.513 . . . . 0.0 114.191 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.458 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 41.5 m-85 -71.18 -18.4 62.49 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.329 -0.857 . . . . 0.0 109.076 168.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 pt -145.8 170.77 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.323 2.249 . . . . 0.0 108.734 -178.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.4 m -107.44 161.19 15.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.052 1.741 . . . . 0.0 108.071 169.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -61.32 -30.94 70.81 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.066 -1.021 . . . . 0.0 112.349 -174.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -57.15 -36.2 70.45 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.686 -0.634 . . . . 0.0 111.823 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -58.07 -45.16 87.56 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 123.834 0.854 . . . . 0.0 110.319 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.7 mt -61.83 -50.7 79.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 124.771 1.228 . . . . 0.0 108.486 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -68.29 -26.57 65.71 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 118.089 -0.958 . . . . 0.0 111.924 -174.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.77 -44.91 86.52 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.491 1.041 . . . . 0.0 110.477 173.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.6 mt -69.28 -48.55 67.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 86.7 mttt -58.75 -47.68 83.81 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -175.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.79 -44.04 94.55 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 123.996 0.918 . . . . 0.0 111.012 -176.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -61.22 -44.06 97.88 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 122.743 0.417 . . . . 0.0 110.129 176.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.1 m . . . . . 0 CA--C 1.534 0.336 0 C-N-CA 124.07 0.948 . . . . 0.0 111.164 178.855 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 . . . . . 0 N--CA 1.454 -0.274 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.6 mm -124.14 141.5 44.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 mp -130.38 -28.39 2.1 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -169.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.13 161.03 26.54 Favored Pre-proline 0 C--O 1.237 0.396 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -56.72 114.52 1.95 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.017 1.811 . . . . 0.0 109.238 172.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.14 -4.87 57.41 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-O 117.792 -1.56 . . . . 0.0 114.2 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.1 t -129.22 128.53 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.93 1.865 . . . . 0.0 110.212 -169.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -131.67 167.39 19.54 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.292 1.837 . . . . 0.0 109.938 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.448 ' CE ' HD11 ' A' ' 118' ' ' LEU . 8.8 ttm -139.94 57.12 8.87 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.006 0.922 . . . . 0.0 112.151 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -45.81 138.08 11.97 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 121.863 1.709 . . . . 0.0 114.175 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 178.44 154.88 0.39 Allowed 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 129.121 2.968 . . . . 0.0 105.67 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -133.72 161.43 34.71 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 170.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -56.64 149.36 41.54 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-O 118.687 -0.673 . . . . 0.0 109.351 178.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -47.72 -41.01 31.54 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 123.131 2.554 . . . . 0.0 112.767 -177.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -62.74 -15.44 53.12 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.352 1.461 . . . . 0.0 113.285 -177.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 84.7 m -79.8 -2.01 41.4 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.86 0.864 . . . . 0.0 111.705 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.99 20.07 1.51 Allowed Glycine 0 CA--C 1.523 0.548 0 CA-C-O 118.493 -1.171 . . . . 0.0 112.941 174.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.39 148.91 48.97 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 119.415 1.607 . . . . 0.0 108.665 169.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.7 mt -129.53 -33.69 1.85 Allowed 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.259 1.024 . . . . 0.0 110.529 -176.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.458 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 73.7 mttt -145.67 153.85 41.46 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 125.281 1.432 . . . . 0.0 107.694 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.7 m -84.8 126.55 33.53 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 122.854 0.462 . . . . 0.0 109.985 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.95 179.67 42.13 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.665 1.126 . . . . 0.0 110.385 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 60.3 mtp -147.82 168.47 22.1 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.298 1.039 . . . . 0.0 112.767 -173.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -138.65 164.14 30.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.251 1.821 . . . . 0.0 109.441 174.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.458 HD22 HD11 ' A' ' 144' ' ' ILE . 31.3 tp -146.77 100.93 3.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.135 2.174 . . . . 0.0 108.837 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.497 ' O ' HD22 ' A' ' 99' ' ' LEU . 92.2 m -117.27 135.19 54.0 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.316 1.046 . . . . 0.0 109.407 -172.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.4 tp -124.99 139.22 54.01 Favored 'General case' 0 CA--C 1.526 0.036 0 C-N-CA 123.795 0.838 . . . . 0.0 108.833 174.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mp -118.3 126.41 52.07 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 126.519 1.928 . . . . 0.0 105.828 175.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -72.23 -35.23 68.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 119.039 0.836 . . . . 0.0 112.31 -178.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 52.1 mm-40 -81.07 -20.08 42.33 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.633 0.773 . . . . 0.0 111.241 172.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 65.2 -174.5 16.5 Favored Glycine 0 CA--C 1.532 1.142 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 -168.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -146.7 165.38 7.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 105.779 -1.934 . . . . 0.0 105.779 168.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -126.75 94.3 4.01 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -169.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 . . . . . 0 CA--C 1.542 0.669 0 C-N-CA 124.478 1.111 . . . . 0.0 110.948 174.844 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo . . . . . 0 N--CA 1.46 -0.447 0 CA-C-O 121.597 0.582 . . . . 0.0 112.558 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 40.5 mm -116.82 132.4 66.64 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 106.97 -1.493 . . . . 0.0 106.97 178.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -98.63 -35.48 10.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 117.658 -1.163 . . . . 0.0 109.55 169.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.497 HD22 ' O ' ' A' ' 82' ' ' THR . 3.2 tm? -115.51 129.96 56.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 119.804 1.184 . . . . 0.0 110.512 -169.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mp -131.38 104.74 7.18 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.513 ' HB ' HD11 ' A' ' 122' ' ' LEU . 0.5 OUTLIER -80.27 138.96 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 168.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -99.42 148.88 18.81 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 108.312 -1.915 . . . . 0.0 108.312 169.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.75 137.55 25.21 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.001 -1.851 . . . . 0.0 106.001 169.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 92.6 p -132.07 147.44 52.44 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 126.305 1.842 . . . . 0.0 106.188 168.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -148.0 133.6 18.79 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -178.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.15 -18.53 59.08 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.239 -0.41 . . . . 0.0 111.781 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -144.25 153.38 41.98 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.852 0.861 . . . . 0.0 110.079 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.17 -35.23 74.88 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.48 -31.12 62.1 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 120.933 -1.104 . . . . 0.0 111.086 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.9 m -64.63 -39.2 93.29 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.845 -0.534 . . . . 0.0 110.261 170.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -58.55 -49.97 75.48 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 123.508 0.723 . . . . 0.0 109.798 171.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 16.4 mm -55.29 -52.13 48.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.94 -41.0 99.19 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 118.971 0.805 . . . . 0.0 111.761 -176.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.27 -46.61 73.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.483 0.713 . . . . 0.0 110.725 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.2 mm -57.72 -46.71 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 124.853 1.261 . . . . 0.0 108.632 176.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -68.21 -14.91 63.34 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.299 -0.876 . . . . 0.0 111.512 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -90.15 -47.38 7.84 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 123.895 0.878 . . . . 0.0 109.539 174.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.448 HD11 ' CE ' ' A' ' 65' ' ' MET . 4.3 pp -70.58 -25.83 63.25 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 121.75 -0.594 . . . . 0.0 111.51 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.0 m -60.77 -21.99 63.61 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 172.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.72 -17.13 64.7 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.35 0.977 . . . . 0.0 110.268 173.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 44.9 mt -105.71 -61.85 1.44 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.26 1.424 . . . . 0.0 109.883 177.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.513 HD11 ' HB ' ' A' ' 101' ' ' ILE . 16.6 mt -68.97 -12.73 61.93 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -173.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.3 m -118.38 29.04 7.99 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.993 0.815 . . . . 0.0 110.4 177.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -131.86 99.71 4.84 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.577 1.151 . . . . 0.0 108.052 175.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -57.47 -25.6 59.96 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.038 -0.983 . . . . 0.0 112.488 -176.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -62.68 -48.98 76.91 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.139 0.576 . . . . 0.0 109.822 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.64 -41.26 85.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 123.9 0.88 . . . . 0.0 108.814 178.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 122' ' ' LEU . 34.5 mt -53.91 -43.44 69.73 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 118.64 0.655 . . . . 0.0 111.605 -172.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -69.87 -32.31 70.6 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.449 0.568 . . . . 0.0 110.234 -178.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -71.18 -36.68 72.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -178.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 48.6 mt -62.24 -55.57 27.13 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 169.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 58.2 mt -62.42 -9.43 8.35 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -172.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 67.9 p -121.78 4.83 10.0 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.342 1.457 . . . . 0.0 111.546 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.53 113.01 2.21 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.054 0.942 . . . . 0.0 110.527 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.1 m -75.16 -22.49 58.07 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.632 0.773 . . . . 0.0 111.942 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.2 m -147.13 155.49 42.19 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.867 0.867 . . . . 0.0 109.895 -169.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -62.18 -31.93 72.49 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 123.775 0.83 . . . . 0.0 110.506 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -57.61 -36.5 71.85 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 123.06 0.544 . . . . 0.0 111.756 173.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -68.15 -38.07 81.74 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.75 0.82 . . . . 0.0 111.438 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 59.4 mt -68.46 -46.56 69.44 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -56.97 -35.2 68.87 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.277 1.031 . . . . 0.0 112.83 173.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -63.22 -45.18 92.82 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 119.36 0.982 . . . . 0.0 110.064 176.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 83.6 mt -62.73 -37.62 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 C-N-CA 123.955 0.902 . . . . 0.0 109.936 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . 0.458 HD11 HD22 ' A' ' 81' ' ' LEU . 25.0 mm -60.39 -49.01 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 118.412 0.551 . . . . 0.0 110.409 170.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 44.2 m -66.16 -24.96 66.74 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -168.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -65.31 -33.52 76.17 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.85 0.75 . . . . 0.0 111.118 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.132 0 CA-C-O 117.52 -1.711 . . . . 0.0 109.197 -169.398 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.0 ttm . . . . . 0 N--CA 1.487 1.396 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -64.17 114.27 4.09 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -54.35 -43.73 71.55 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.141 1.376 . . . . 0.0 109.457 -178.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.8 -18.43 8.52 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.246 1.418 . . . . 0.0 113.183 -177.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -66.99 -31.12 71.46 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.449 1.022 . . . . 0.0 111.648 176.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -87.86 -30.65 20.0 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.508 -0.758 . . . . 0.0 112.346 -173.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -91.13 109.81 37.97 Favored Pre-proline 0 CA--C 1.543 0.706 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -176.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.3 -83.55 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.835 2.357 . . . . 0.0 112.625 -169.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -157.39 163.21 38.82 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 127.257 2.223 . . . . 0.0 106.113 172.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 57.58 5.06 0.28 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.771 1.628 . . . . 0.0 113.125 -175.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.4 p -81.98 1.28 36.21 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.734 2.814 . . . . 0.0 113.393 -168.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.4 mt -131.61 123.26 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -169.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.0 m -142.6 146.42 34.54 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 123.413 0.446 . . . . 0.0 111.488 -176.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -118.81 141.25 39.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 105.496 -2.039 . . . . 0.0 105.496 169.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.3 mt -140.69 148.23 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 C-N-CA 125.714 1.606 . . . . 0.0 107.441 -169.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -69.37 -52.62 25.36 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 172.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 t -162.03 163.56 28.72 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 169.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.93 158.45 21.57 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.92 -0.771 . . . . 0.0 108.92 173.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -59.07 -43.43 91.75 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.419 174.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -164.53 177.41 8.14 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 128.031 2.532 . . . . 0.0 107.555 173.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -55.52 -37.88 68.49 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.028 1.731 . . . . 0.0 113.819 176.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.409 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.9 mt-30 -62.64 -49.71 74.09 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 120.158 1.345 . . . . 0.0 108.489 173.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -60.41 -33.28 72.28 Favored 'General case' 0 C--O 1.223 -0.314 0 O-C-N 121.906 -0.496 . . . . 0.0 111.707 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.32 -37.3 86.67 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.645 -0.66 . . . . 0.0 110.637 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.97 -47.14 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 170.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -58.87 -48.97 79.51 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 123.266 0.626 . . . . 0.0 110.374 -174.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -60.81 -31.32 70.72 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.508 1.123 . . . . 0.0 111.4 173.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.9 m -82.66 -9.02 59.56 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 119.566 1.075 . . . . 0.0 113.676 179.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 14.2 mmt -121.26 -20.93 6.54 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.12 0.873 . . . . 0.0 112.821 -176.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.8 p -57.47 -34.03 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 120.352 1.433 . . . . 0.0 111.982 -173.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.0 m -65.07 -29.43 70.31 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.211 0.914 . . . . 0.0 111.902 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.2 mt -79.5 -42.47 25.15 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.092 0.957 . . . . 0.0 108.737 173.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.6 -44.01 85.11 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.921 0.888 . . . . 0.0 110.763 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.6 -28.76 67.46 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 126.651 1.98 . . . . 0.0 113.136 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -111.4 21.06 16.65 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.292 0.7 OUTLIER 47.99 33.44 3.44 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.132 1.773 . . . . 0.0 114.67 -178.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -67.86 -22.18 65.13 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.865 -1.147 . . . . 0.0 111.318 169.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.1 pt -145.37 172.59 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 C-N-CA 126.26 1.824 . . . . 0.0 108.235 -174.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 m -108.98 161.04 15.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.618 1.567 . . . . 0.0 108.366 172.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.57 -32.54 72.64 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.863 -1.148 . . . . 0.0 111.464 -178.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -59.01 -36.31 74.71 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.771 -0.581 . . . . 0.0 111.877 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -58.73 -48.24 81.84 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 123.386 0.674 . . . . 0.0 109.487 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 28.8 mt -57.97 -49.91 79.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 124.336 1.054 . . . . 0.0 108.923 178.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -68.19 -26.96 66.0 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.06 -0.971 . . . . 0.0 111.831 -175.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.24 -40.1 89.06 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.812 1.187 . . . . 0.0 110.815 172.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.7 mt -67.97 -51.91 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.409 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.0 mttt -58.9 -43.84 91.08 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -175.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -63.76 -45.76 88.35 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.465 1.106 . . . . 0.0 111.124 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 27.7 m -63.22 -38.2 90.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.402 0.546 . . . . 0.0 110.794 177.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 88.0 m . . . . . 0 N--CA 1.45 -0.44 0 C-N-CA 124.136 0.974 . . . . 0.0 109.578 177.404 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 C--O 1.235 0.303 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.7 mm -131.22 134.33 61.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 102.179 -3.267 . . . . 0.0 102.179 172.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -116.92 -28.92 6.15 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -168.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -165.73 163.67 12.42 Favored Pre-proline 0 C--O 1.237 0.437 0 C-N-CA 125.311 1.444 . . . . 0.0 107.536 -177.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -46.52 116.88 1.76 Allowed 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 123.027 2.485 . . . . 0.0 110.993 169.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.8 0.93 83.28 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.47 -1.739 . . . . 0.0 114.888 175.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.2 t -127.83 126.59 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 120.232 2.016 . . . . 0.0 109.605 -170.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.15 164.58 22.17 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 125.595 1.558 . . . . 0.0 110.06 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 tmm? -149.05 76.95 9.35 Favored Pre-proline 0 C--O 1.223 -0.313 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -59.04 -89.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 122.849 2.366 . . . . 0.0 114.985 -169.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . 0.254 0.0 OUTLIER 51.26 177.15 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.025 2.13 . . . . 0.0 113.943 -169.176 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.53 159.88 40.21 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 125.307 1.443 . . . . 0.0 108.568 177.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -62.53 147.78 91.75 Favored Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.09 177.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -44.58 -44.42 13.76 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 124.479 3.452 . . . . 0.0 114.032 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.42 -12.04 12.86 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.286 1.435 . . . . 0.0 113.843 -176.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 60.0 m -79.28 -4.15 49.38 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.615 0.643 . . . . 0.0 111.62 179.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 127.36 19.2 1.93 Allowed Glycine 0 C--N 1.337 0.622 0 CA-C-O 118.539 -1.145 . . . . 0.0 113.249 175.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.49 149.32 50.23 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 119.206 1.503 . . . . 0.0 109.075 169.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -130.78 -31.52 1.74 Allowed 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.375 1.07 . . . . 0.0 110.661 -174.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -146.18 157.35 43.82 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.011 1.324 . . . . 0.0 108.951 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.427 ' HA ' ' O ' ' A' ' 104' ' ' SER . 89.7 m -90.31 126.15 35.76 Favored 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 123.041 0.536 . . . . 0.0 110.203 -177.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -168.98 -174.52 37.62 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 125.482 1.515 . . . . 0.0 111.252 -175.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 40.8 mtt -151.42 170.06 20.5 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.103 1.761 . . . . 0.0 111.064 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 36.6 m -153.41 169.65 22.63 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.56 1.544 . . . . 0.0 109.931 171.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 18.1 tp -142.91 130.18 20.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 127.145 2.178 . . . . 0.0 109.561 -169.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.475 ' O ' HD22 ' A' ' 99' ' ' LEU . 35.7 m -136.52 133.86 36.93 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -176.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 17.3 tp -125.38 134.51 52.14 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 171.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.5 mp -110.63 133.52 53.25 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 173.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -67.6 -43.87 79.46 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 118.308 0.504 . . . . 0.0 110.676 176.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -84.54 -24.73 29.17 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.806 0.842 . . . . 0.0 112.271 -177.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 71.69 165.54 7.27 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -168.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -135.2 163.47 35.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 169.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -120.55 93.36 4.02 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.867 0.841 . . . . 0.0 111.422 -168.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 . . . . . 0 CA--C 1.538 0.508 0 CA-C-N 114.66 -1.154 . . . . 0.0 112.221 171.015 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo . . . . . 0 N--CA 1.457 -0.647 0 CA-C-O 121.035 0.348 . . . . 0.0 112.93 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.6 mm -115.81 128.23 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 174.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -94.43 -34.01 12.9 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.458 -1.258 . . . . 0.0 109.858 169.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.475 HD22 ' O ' ' A' ' 82' ' ' THR . 3.1 tm? -119.51 131.15 55.5 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 120.333 1.424 . . . . 0.0 110.17 -169.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mp -129.37 135.4 48.67 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -111.32 132.16 60.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 168.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -103.38 157.46 17.66 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.478 HD23 ' N ' ' A' ' 104' ' ' SER . 0.7 OUTLIER -146.95 154.59 41.44 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 -179.827 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.478 ' N ' HD23 ' A' ' 103' ' ' LEU . 88.3 p -142.85 146.15 33.85 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 104.63 -2.359 . . . . 0.0 104.63 168.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.23 129.43 12.77 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 119.535 1.061 . . . . 0.0 108.987 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -74.57 -18.92 60.5 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.819 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -141.86 151.97 43.2 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 123.715 0.806 . . . . 0.0 110.328 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.65 -33.66 73.13 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -175.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -78.21 -31.06 49.21 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 119.313 0.96 . . . . 0.0 111.061 177.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.0 m -62.81 -39.4 94.18 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 169.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.91 -48.34 80.17 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.387 1.075 . . . . 0.0 110.483 171.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.5 mm -58.71 -51.89 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.49 -38.8 95.43 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 118.912 0.778 . . . . 0.0 111.651 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.8 -53.5 39.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.306 1.042 . . . . 0.0 110.394 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.4 mm -51.17 -48.16 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.663 1.585 . . . . 0.0 108.56 176.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -68.27 -16.09 63.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.425 0.69 . . . . 0.0 112.006 -176.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -87.5 -44.83 11.0 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.631 0.773 . . . . 0.0 109.613 172.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.403 HD21 HD12 ' A' ' 103' ' ' LEU . 3.8 pp -68.78 -25.77 64.87 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 118.662 0.664 . . . . 0.0 111.316 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 49.1 m -60.79 -21.88 63.53 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 123.759 0.823 . . . . 0.0 112.32 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -66.5 -17.68 64.94 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.307 0.958 . . . . 0.0 110.299 173.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 36.1 mt -105.95 -58.69 1.88 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.382 1.473 . . . . 0.0 109.898 177.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.8 -28.13 65.7 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 114.433 1.272 . . . . 0.0 114.433 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 42.0 m -108.52 26.73 10.15 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.912 0.778 . . . . 0.0 110.844 -175.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -132.42 97.51 4.12 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 124.679 1.192 . . . . 0.0 108.054 178.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.54 -27.46 49.06 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.841 0.856 . . . . 0.0 112.526 -177.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.13 -44.83 87.42 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.104 0.562 . . . . 0.0 110.013 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.62 -44.98 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 174.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.8 mt -53.74 -45.73 70.62 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 118.429 0.559 . . . . 0.0 111.555 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -65.78 -38.55 89.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.435 0.561 . . . . 0.0 110.705 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.401 ' HB3' HD11 ' A' ' 143' ' ' ILE . 45.1 mt-30 -70.1 -32.45 70.51 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 118.64 0.654 . . . . 0.0 110.11 -177.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 25.6 mt -68.75 -52.97 24.82 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 55.1 mt -59.17 -13.12 6.37 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -176.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 81.4 p -123.84 10.87 8.97 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.223 1.409 . . . . 0.0 110.898 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.01 119.02 5.58 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 124.624 1.17 . . . . 0.0 109.879 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.5 p -71.95 -16.17 62.09 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.321 1.048 . . . . 0.0 112.307 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 73.4 p -159.38 164.87 34.31 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.571 0.623 . . . . 0.0 111.067 -172.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.27 -33.81 75.35 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 169.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -60.36 -37.47 80.8 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 121.827 -0.545 . . . . 0.0 111.573 174.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -77.28 -28.54 53.43 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 119.703 1.138 . . . . 0.0 110.713 179.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 35.2 mt -65.44 -48.63 72.09 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 120.286 1.403 . . . . 0.0 108.289 169.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.04 -34.1 69.71 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.821 1.248 . . . . 0.0 113.189 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -63.17 -42.01 99.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 119.066 0.848 . . . . 0.0 110.487 176.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.401 HD11 ' HB3' ' A' ' 130' ' ' GLN . 91.4 mt -68.47 -36.54 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 123.343 0.657 . . . . 0.0 109.527 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.3 mm -57.85 -52.64 55.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 169.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 28.8 m -64.11 -28.02 69.49 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 122.816 0.446 . . . . 0.0 111.484 -170.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -59.64 -28.5 67.28 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.675 1.59 . . . . 0.0 113.396 175.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.911 0 N-CA-C 108.904 -1.679 . . . . 0.0 108.904 -174.452 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 tpt . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -65.98 110.0 2.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 168.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.51 -45.99 66.46 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.683 0.793 . . . . 0.0 109.746 -175.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.47 -19.93 6.66 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.279 1.832 . . . . 0.0 113.143 -176.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.4 -31.47 72.15 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 119.349 0.977 . . . . 0.0 111.995 175.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -88.3 -22.38 23.92 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.686 -174.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -99.4 100.14 9.9 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 -173.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.18 -81.13 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 123.689 2.926 . . . . 0.0 113.298 -169.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -157.05 161.03 39.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.43 2.292 . . . . 0.0 105.485 172.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 m 59.06 -0.12 0.15 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.568 1.547 . . . . 0.0 113.075 -174.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.1 p -80.05 4.65 16.43 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 128.397 2.679 . . . . 0.0 112.708 -169.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 6.6 mt -133.32 132.04 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 N-CA-C 104.145 -2.539 . . . . 0.0 104.145 -173.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.0 m -156.15 147.4 22.44 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 118.685 0.675 . . . . 0.0 111.066 -179.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 85.3 t -116.67 143.45 26.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 169.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mt -138.7 147.51 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 C-N-CA 126.245 1.818 . . . . 0.0 106.31 -172.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -72.47 -47.51 48.18 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.594 -0.691 . . . . 0.0 109.713 172.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.2 p -160.67 141.91 12.0 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.073 -1.455 . . . . 0.0 107.073 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.82 155.1 35.71 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -56.34 -44.83 80.42 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.631 0.772 . . . . 0.0 109.716 177.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -163.58 -176.92 4.93 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.824 2.05 . . . . 0.0 108.242 170.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -64.3 -32.79 74.52 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.485 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 35.0 mt-30 -58.88 -50.52 73.69 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.805 1.639 . . . . 0.0 107.206 171.188 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -60.73 -35.22 75.8 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 121.795 -0.566 . . . . 0.0 111.806 177.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.97 -31.94 72.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 121.894 -0.504 . . . . 0.0 110.905 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.25 -48.53 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 170.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -55.96 -45.63 78.84 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 118.23 0.468 . . . . 0.0 110.442 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -64.69 -28.91 69.92 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 118.031 -0.985 . . . . 0.0 112.343 174.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.9 m -69.9 -19.95 63.39 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.223 1.374 . . . . 0.0 112.224 172.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.2 mmt -123.86 -18.68 5.93 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -168.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.2 p -57.03 -37.88 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 120.273 1.397 . . . . 0.0 112.591 -169.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.3 m -67.21 -27.7 67.46 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.825 0.738 . . . . 0.0 111.568 -178.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.4 mt -77.43 -44.37 29.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.649 0.78 . . . . 0.0 108.986 172.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -56.4 -51.02 69.91 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.109 0.964 . . . . 0.0 110.092 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -56.21 -28.59 58.85 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 126.576 1.95 . . . . 0.0 113.757 -176.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -113.71 24.45 12.12 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 123.057 0.543 . . . . 0.0 109.996 -175.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 61.66 20.69 11.54 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 171.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -71.24 -24.18 62.14 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.894 -1.129 . . . . 0.0 111.158 174.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.4 pt -143.88 176.3 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.101 1.76 . . . . 0.0 108.929 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m -114.26 160.56 18.9 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.597 1.959 . . . . 0.0 108.203 175.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -59.02 -37.47 76.98 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.907 1.231 . . . . 0.0 111.826 -175.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -60.71 -22.54 64.07 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.797 0.839 . . . . 0.0 113.206 175.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -65.25 -45.58 83.98 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.798 1.181 . . . . 0.0 109.934 174.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.99 -50.53 79.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -69.86 -23.86 63.34 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.952 -173.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.01 -42.7 90.74 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 120.149 1.341 . . . . 0.0 111.025 172.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.5 mt -70.09 -46.3 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.5 mttt -61.64 -40.62 95.55 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -65.13 -38.55 91.01 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 124.176 0.99 . . . . 0.0 111.445 178.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.9 m -61.72 -42.05 98.43 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.733 -0.604 . . . . 0.0 109.603 171.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 22.6 m . . . . . 0 CA--C 1.545 0.756 0 O-C-N 121.463 -0.773 . . . . 0.0 110.915 177.895 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.6 mm -124.91 136.02 62.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -121.97 -31.26 3.94 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 123.651 0.78 . . . . 0.0 110.923 -172.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.77 160.21 30.16 Favored Pre-proline 0 CA--C 1.534 0.351 0 C-N-CA 125.883 1.673 . . . . 0.0 106.708 173.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -49.84 119.91 5.36 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.394 2.063 . . . . 0.0 109.979 169.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.9 -6.2 73.07 Favored Glycine 0 CA--C 1.532 1.104 0 CA-C-O 117.843 -1.532 . . . . 0.0 114.465 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.6 t -126.25 117.35 48.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 119.769 1.785 . . . . 0.0 108.339 -170.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -118.76 168.8 10.4 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.412 1.085 . . . . 0.0 110.246 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.528 ' CE ' HD11 ' A' ' 118' ' ' LEU . 7.2 ttm -140.69 62.31 17.72 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 122.93 0.492 . . . . 0.0 111.99 177.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.59 135.64 48.54 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 121.56 1.506 . . . . 0.0 111.83 -179.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 176.42 157.61 0.27 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 128.28 2.632 . . . . 0.0 106.221 -170.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.13 163.92 30.46 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.207 1.403 . . . . 0.0 108.224 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -58.11 153.91 32.89 Favored Pre-proline 0 N--CA 1.465 0.312 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.104 175.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.3 -39.21 91.56 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 122.13 1.886 . . . . 0.0 110.446 -172.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -61.86 -15.31 41.27 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.704 1.602 . . . . 0.0 113.055 -178.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 83.7 m -79.11 -8.61 59.12 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.656 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 139.02 13.5 0.69 Allowed Glycine 0 C--N 1.339 0.736 0 CA-C-O 117.825 -1.542 . . . . 0.0 114.206 173.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.29 147.49 52.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.854 1.827 . . . . 0.0 109.625 173.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.1 mt -130.6 -35.55 1.48 Allowed 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.309 1.043 . . . . 0.0 110.32 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -148.6 158.34 44.06 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.292 1.437 . . . . 0.0 108.542 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 83.4 m -90.29 133.74 34.75 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 122.988 0.515 . . . . 0.0 111.927 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -177.34 -179.14 47.49 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.923 1.249 . . . . 0.0 111.11 -177.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 24.2 mtm -146.65 169.67 18.53 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 126.241 1.816 . . . . 0.0 110.775 -179.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.0 m -151.04 170.61 18.96 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.473 1.509 . . . . 0.0 109.425 171.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.418 HD22 HD11 ' A' ' 144' ' ' ILE . 28.9 tp -145.78 131.02 18.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 127.854 2.461 . . . . 0.0 108.408 -169.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 28.6 m -140.78 137.19 33.18 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -173.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -129.27 141.44 51.11 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 172.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.7 mp -119.61 126.83 52.12 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 126.398 1.879 . . . . 0.0 106.368 176.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.42 -44.73 90.32 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.423 0.556 . . . . 0.0 111.251 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 38.1 mm-40 -85.53 -23.54 27.65 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 124.292 1.037 . . . . 0.0 111.667 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 73.97 176.18 33.75 Favored Glycine 0 CA--C 1.532 1.145 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -168.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.93 160.27 13.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 169.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -109.76 101.61 10.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.67 0.748 . . . . 0.0 110.543 -168.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 . . . . . 0 CA--C 1.541 0.633 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.448 169.887 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo . . . . . 0 N--CA 1.46 -0.498 0 N-CA-C 113.407 0.503 . . . . 0.0 113.407 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 22.9 mm -84.93 136.32 23.01 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.291 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 172.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -111.59 -18.46 12.8 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 117.686 -1.149 . . . . 0.0 110.625 170.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 131' ' ' LEU . 15.3 tp -140.4 135.56 32.21 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 120.001 1.273 . . . . 0.0 109.818 -173.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.3 mp -138.6 138.37 37.84 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 -174.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.1 mt -115.24 128.93 72.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 168.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.28 149.95 21.66 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 108.592 -1.803 . . . . 0.0 108.592 170.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 104' ' ' SER . 0.5 OUTLIER -148.6 144.82 27.48 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 172.846 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.541 ' N ' HD23 ' A' ' 103' ' ' LEU . 77.9 p -142.48 145.95 34.25 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 168.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.474 ' HB3' ' CG ' ' A' ' 111' ' ' HIS . . . -145.96 145.85 30.81 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 118.553 0.615 . . . . 0.0 109.706 171.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.89 -16.94 59.96 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.477 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -137.61 155.8 48.78 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.362 0.665 . . . . 0.0 110.746 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.37 -38.62 90.27 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.342 0.657 . . . . 0.0 112.472 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -73.05 -31.1 64.2 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.211 -0.93 . . . . 0.0 110.837 178.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.3 m -64.36 -37.99 89.44 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.289 169.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.474 ' CG ' ' HB3' ' A' ' 105' ' ' ALA . 24.0 m80 -62.23 -44.64 96.1 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.779 171.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.6 -51.28 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-N 119.141 0.882 . . . . 0.0 108.874 177.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.59 -40.72 96.74 Favored Glycine 0 CA--C 1.531 1.063 0 CA-C-N 119.063 0.847 . . . . 0.0 111.916 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.15 70.7 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.617 0.767 . . . . 0.0 111.096 -179.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 5.0 mm -58.91 -46.12 91.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 125.201 1.4 . . . . 0.0 108.168 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.1 mm-40 -69.02 -9.97 55.18 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.135 -0.978 . . . . 0.0 111.623 -178.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.41 -50.63 5.54 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.929 0.892 . . . . 0.0 108.93 172.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.528 HD11 ' CE ' ' A' ' 65' ' ' MET . 3.9 pp -68.52 -27.34 66.02 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.773 -0.579 . . . . 0.0 111.646 -176.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.4 m -62.42 -20.98 65.04 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.318 0.508 . . . . 0.0 112.062 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -64.16 -19.12 65.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.283 0.947 . . . . 0.0 110.096 171.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 33.4 mt -108.12 -60.54 1.71 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.022 1.729 . . . . 0.0 110.941 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.4 mt -65.75 -18.13 65.11 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -175.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.6 m -111.39 26.84 10.25 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.268 0.94 . . . . 0.0 110.887 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -139.54 97.47 3.28 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -172.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -55.83 -27.39 51.24 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.789 0.836 . . . . 0.0 112.418 -175.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -61.95 -45.08 95.22 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 122.875 0.47 . . . . 0.0 110.125 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.5 mp -71.69 -45.04 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 123.662 0.785 . . . . 0.0 108.887 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.0 mt -55.69 -41.67 74.06 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.026 -172.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -70.83 -33.98 71.22 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 118.435 0.561 . . . . 0.0 110.327 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -66.13 -41.65 90.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.222 0.919 . . . . 0.0 108.764 179.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.465 HD13 HD21 ' A' ' 99' ' ' LEU . 21.4 mt -69.02 -48.08 63.86 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 64.1 mt -62.66 -5.9 3.1 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 178.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 73.8 p -122.6 11.73 9.89 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.346 1.458 . . . . 0.0 110.923 175.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.17 110.09 2.07 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 124.378 1.071 . . . . 0.0 109.974 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -73.99 -14.71 61.07 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.782 0.833 . . . . 0.0 112.303 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 82.1 p -151.73 163.74 38.48 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 118.943 0.792 . . . . 0.0 110.866 -174.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.74 -39.67 74.4 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.523 1.129 . . . . 0.0 109.671 169.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -59.93 -40.01 87.47 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 123.27 0.628 . . . . 0.0 110.84 177.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -65.85 -38.76 89.73 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 118.865 0.757 . . . . 0.0 112.261 177.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.3 mt -62.79 -48.24 79.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.637 1.108 . . . . 0.0 108.517 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.74 -37.19 73.17 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.561 1.145 . . . . 0.0 113.66 174.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.83 -39.72 95.21 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 121.187 -0.946 . . . . 0.0 110.099 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 49.9 mt -71.93 -35.76 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 123.718 0.807 . . . . 0.0 110.206 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . 0.418 HD11 HD22 ' A' ' 81' ' ' LEU . 17.1 mm -57.01 -46.28 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 118.835 0.743 . . . . 0.0 109.776 169.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 43.8 m -65.02 -22.53 67.01 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -169.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . 0.482 ' HG2' HH11 ' A' ' 146' ' ' ARG . 6.1 mtt-85 -68.11 -35.72 78.59 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.978 0.808 . . . . 0.0 111.509 176.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.154 0 CA-C-O 117.779 -1.567 . . . . 0.0 110.834 -168.764 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.759 0.314 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -65.44 115.18 5.42 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -53.67 -45.33 70.25 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.466 1.104 . . . . 0.0 108.457 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.42 -27.1 5.83 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 126.519 1.928 . . . . 0.0 113.34 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.52 -28.38 68.36 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.947 0.794 . . . . 0.0 112.539 178.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -93.09 -14.68 26.97 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.03 0.932 . . . . 0.0 113.085 -173.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -102.65 114.43 65.33 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 120.561 1.528 . . . . 0.0 108.589 -173.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.82 -76.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.436 2.757 . . . . 0.0 113.46 -176.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.401 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.7 tp10 -162.52 -68.84 0.05 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.432 1.093 . . . . 0.0 110.957 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -67.32 4.53 0.95 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.923 1.289 . . . . 0.0 112.077 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.401 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -70.51 -8.73 53.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.534 1.934 . . . . 0.0 113.056 -170.742 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.9 mt -120.52 125.5 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -169.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.6 m -145.27 149.58 35.11 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.321 0.581 . . . . 0.0 111.219 -175.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.5 t -126.25 138.49 54.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 170.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.1 mt -139.25 150.45 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 -174.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -70.19 -46.69 64.07 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.699 -0.625 . . . . 0.0 110.282 177.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.1 p -164.15 146.66 9.15 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.604 ' HB3' HG21 ' A' ' 88' ' ' VAL . . . -76.89 160.98 28.77 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -57.48 -43.39 84.04 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.07 0.548 . . . . 0.0 110.417 173.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -168.35 178.86 4.69 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 127.038 2.135 . . . . 0.0 108.342 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -61.81 -34.33 75.74 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.807 1.643 . . . . 0.0 113.045 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.436 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 53.9 mm-40 -62.03 -50.93 70.03 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.663 1.574 . . . . 0.0 107.834 169.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -60.25 -35.44 75.5 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 121.836 -0.54 . . . . 0.0 111.705 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.1 -31.89 73.14 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.555 0.742 . . . . 0.0 110.751 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -71.16 -46.71 64.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 173.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -56.93 -45.86 82.45 Favored 'General case' 0 C--O 1.226 -0.18 0 O-C-N 121.656 -0.653 . . . . 0.0 110.517 178.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -64.1 -30.33 71.41 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.375 -0.821 . . . . 0.0 111.894 174.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 m -67.45 -27.29 66.91 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.587 1.085 . . . . 0.0 112.173 173.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 2.2 mmm -119.79 -13.54 9.09 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.087 1.312 . . . . 0.0 114.425 -169.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.6 p -58.21 -39.13 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 120.792 1.633 . . . . 0.0 112.723 -169.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.0 m -66.11 -22.78 66.41 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.017 0.826 . . . . 0.0 111.908 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.7 mt -82.55 -43.05 17.58 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.061 0.944 . . . . 0.0 108.925 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.82 -49.96 71.83 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.094 0.958 . . . . 0.0 109.737 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.58 -30.6 61.13 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 126.212 1.805 . . . . 0.0 113.947 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.8 mttm -111.27 22.66 14.94 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.35 -175.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 57.74 25.42 11.83 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.463 -0.79 . . . . 0.0 113.054 173.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -69.12 -25.72 64.54 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.279 -0.888 . . . . 0.0 110.368 169.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.3 pt -144.47 176.54 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 125.759 1.623 . . . . 0.0 109.288 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.5 m -116.61 159.1 22.66 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.7 2.0 . . . . 0.0 108.04 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -58.56 -33.44 69.92 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.651 1.114 . . . . 0.0 113.22 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -57.02 -32.23 65.94 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.169 0.587 . . . . 0.0 111.775 175.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -60.23 -45.77 92.09 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.366 0.666 . . . . 0.0 110.421 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.31 -49.32 83.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -69.6 -24.54 63.68 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.219 -177.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.47 -44.42 94.46 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 120.084 1.311 . . . . 0.0 110.488 174.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 56.1 mt -67.04 -47.04 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.5 mttt -58.67 -43.91 90.05 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 117.89 0.314 . . . . 0.0 110.781 -178.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -67.41 -39.87 85.54 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 124.272 1.029 . . . . 0.0 110.934 -178.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.6 m -62.14 -40.59 96.45 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.281 0.562 . . . . 0.0 110.223 173.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.4 m . . . . . 0 CA--C 1.54 0.562 0 C-N-CA 124.01 0.924 . . . . 0.0 110.917 177.817 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 23.8 mm -141.19 139.13 33.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 mp -132.09 -25.8 1.98 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -170.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.13 161.43 25.85 Favored Pre-proline 0 C--O 1.237 0.401 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 176.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -49.63 116.38 2.31 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.487 2.125 . . . . 0.0 111.005 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.55 4.92 69.84 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.152 -1.36 . . . . 0.0 114.501 177.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.6 t -129.5 122.69 55.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-N 119.33 1.565 . . . . 0.0 108.81 -169.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -121.09 166.03 14.49 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.297 1.439 . . . . 0.0 110.122 177.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 24.7 ttm -136.41 63.88 50.22 Favored Pre-proline 0 CA--C 1.542 0.663 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.73 173.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.52 147.57 22.68 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.18 1.92 . . . . 0.0 113.865 -173.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 174.07 154.92 0.12 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.535 2.334 . . . . 0.0 107.329 -169.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.66 151.7 50.47 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 106.657 -1.609 . . . . 0.0 106.657 169.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -53.6 141.86 43.62 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-O 117.429 -1.272 . . . . 0.0 109.265 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -43.67 -44.46 11.24 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 124.24 3.293 . . . . 0.0 114.645 -170.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -63.73 -9.23 13.18 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.689 1.196 . . . . 0.0 114.023 -177.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 61.7 m -76.63 -1.66 28.8 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.128 0.971 . . . . 0.0 111.867 175.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 129.09 13.48 2.4 Favored Glycine 0 C--N 1.336 0.577 0 CA-C-O 118.185 -1.341 . . . . 0.0 112.985 172.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.4 148.26 52.02 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 119.342 1.571 . . . . 0.0 109.278 170.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 86.2 mt -133.04 -31.05 1.3 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 124.751 1.22 . . . . 0.0 110.975 -173.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -143.91 166.84 23.81 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 126.057 1.743 . . . . 0.0 107.042 178.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.2 m -101.93 125.91 48.71 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 123.17 0.588 . . . . 0.0 109.734 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -174.28 175.76 46.67 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.714 1.149 . . . . 0.0 111.276 -177.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.7 ' SD ' HD21 ' A' ' 118' ' ' LEU . 56.8 mtt -140.72 167.71 21.53 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.803 1.241 . . . . 0.0 112.246 -170.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 p -144.25 165.33 28.18 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.136 1.774 . . . . 0.0 109.377 178.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.489 HD22 HD11 ' A' ' 144' ' ' ILE . 34.0 tp -146.92 110.81 5.01 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.191 1.797 . . . . 0.0 107.861 -169.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 31.5 m -127.02 139.35 53.08 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -171.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 12.1 tp -135.22 145.35 47.56 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 174.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -125.01 112.35 16.46 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 126.161 1.785 . . . . 0.0 106.193 -173.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -59.83 -24.79 64.47 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -116.79 -5.32 11.56 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.192 0.997 . . . . 0.0 112.088 -177.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.95 168.58 4.43 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.628 1.109 . . . . 0.0 113.49 -173.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.604 HG21 ' HB3' ' A' ' 18' ' ' ALA . 16.3 t -139.11 148.99 23.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 105.137 -2.172 . . . . 0.0 105.137 174.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -116.42 100.62 8.0 Favored 'General case' 0 C--N 1.334 -0.093 0 O-C-N 121.762 -0.586 . . . . 0.0 110.712 -168.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 CA--C 1.539 0.53 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.679 173.838 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo . . . . . 0 N--CA 1.458 -0.603 0 N-CA-C 110.714 -0.533 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 40.7 mm -99.53 136.91 28.71 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 -177.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -109.72 -14.24 14.36 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 117.161 -1.4 . . . . 0.0 111.096 172.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.511 HD21 HD13 ' A' ' 131' ' ' LEU . 37.3 tp -144.11 131.9 21.36 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 120.603 1.547 . . . . 0.0 110.319 -169.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mp -138.71 117.2 12.07 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 -174.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.735 HG21 HD22 ' A' ' 118' ' ' LEU . 1.4 mp -98.39 111.02 27.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 105.141 -2.17 . . . . 0.0 105.141 173.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.07 151.39 36.91 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 174.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.436 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -143.26 142.93 31.53 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 105.408 -2.071 . . . . 0.0 105.408 172.05 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.436 ' N ' HD23 ' A' ' 103' ' ' LEU . 27.4 p -135.68 144.24 45.87 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 127.248 2.219 . . . . 0.0 106.498 169.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.8 135.94 22.57 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -175.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -77.98 -22.41 49.43 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.723 0.409 . . . . 0.0 111.803 -177.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -144.05 155.67 44.08 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.011 0.924 . . . . 0.0 110.019 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.09 -34.99 74.23 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -177.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -75.97 -32.11 59.33 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.865 -1.147 . . . . 0.0 110.937 177.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.9 m -62.51 -41.12 98.61 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 169.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 23.4 t60 -58.27 -49.93 75.4 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.027 0.931 . . . . 0.0 110.038 173.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.6 mm -55.94 -54.19 29.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 118.875 0.761 . . . . 0.0 109.568 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.06 -38.77 94.79 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.669 0.668 . . . . 0.0 111.702 -176.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.56 -48.49 60.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.466 1.107 . . . . 0.0 111.1 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.32 -43.55 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 124.489 1.115 . . . . 0.0 108.758 176.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -70.47 -11.11 60.71 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.716 0.806 . . . . 0.0 111.991 -178.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.88 -45.32 12.37 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 169.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.735 HD22 HG21 ' A' ' 101' ' ' ILE . 95.8 mt -71.13 -30.29 66.31 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.742 -0.599 . . . . 0.0 112.042 -173.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.1 m -61.44 -21.1 63.83 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 122.98 0.512 . . . . 0.0 112.076 172.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -68.7 -28.18 66.61 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.608 1.094 . . . . 0.0 110.0 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 40.0 mt -96.66 -63.6 1.12 Allowed 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.0 0.92 . . . . 0.0 111.037 -178.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.41 ' HA ' HD21 ' A' ' 128' ' ' LEU . 17.2 mt -73.38 -1.13 16.9 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -169.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 55.6 m -112.04 27.83 9.3 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.529 1.059 . . . . 0.0 111.357 174.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -141.33 97.66 3.21 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -171.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.87 -26.16 58.15 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.658 0.783 . . . . 0.0 112.371 -173.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -63.43 -46.3 86.95 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.224 0.535 . . . . 0.0 109.79 176.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.54 -43.79 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 C-N-CA 124.427 1.091 . . . . 0.0 109.134 176.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 122' ' ' LEU . 46.8 mt -56.52 -44.58 80.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 118.945 -0.55 . . . . 0.0 110.976 -173.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -67.04 -38.54 86.07 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 118.152 0.433 . . . . 0.0 110.367 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.402 ' HB3' HD11 ' A' ' 143' ' ' ILE . 49.2 mt-30 -67.64 -35.86 79.69 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 118.723 0.692 . . . . 0.0 109.696 -177.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.511 HD13 HD21 ' A' ' 99' ' ' LEU . 26.2 mt -70.06 -51.98 27.62 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 173.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 57.4 mt -60.54 -12.03 8.75 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 80.7 p -120.39 8.09 10.75 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.844 1.258 . . . . 0.0 111.321 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.49 114.67 3.08 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.591 1.156 . . . . 0.0 109.782 177.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.8 m -75.5 -20.26 58.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.857 0.863 . . . . 0.0 111.865 178.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.3 m -147.79 157.55 43.59 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.976 0.91 . . . . 0.0 109.939 -169.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -61.01 -38.62 86.72 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.434 1.093 . . . . 0.0 110.522 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -58.61 -36.63 74.32 Favored 'General case' 0 C--O 1.226 -0.178 0 O-C-N 121.946 -0.471 . . . . 0.0 111.389 175.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -68.87 -34.14 74.94 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 123.727 0.811 . . . . 0.0 112.074 177.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . 0.425 ' HB3' HD21 ' A' ' 81' ' ' LEU . 58.6 mt -67.28 -45.46 76.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.733 1.151 . . . . 0.0 107.954 172.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -64.65 -27.08 68.68 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -61.55 -38.84 88.94 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 120.776 -1.203 . . . . 0.0 109.914 174.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.402 HD11 ' HB3' ' A' ' 130' ' ' GLN . 80.1 mt -72.37 -34.99 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 124.514 1.125 . . . . 0.0 109.221 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . 0.489 HD11 HD22 ' A' ' 81' ' ' LEU . 36.3 mm -56.45 -51.76 60.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 169.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.6 m -65.57 -29.59 70.22 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.987 -170.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -61.51 -30.15 70.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.495 1.918 . . . . 0.0 112.569 172.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.006 0 CA-C-O 117.931 -1.483 . . . . 0.0 110.435 -172.357 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 ttt . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.14 112.78 1.3 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.889 0.376 . . . . 0.0 111.792 171.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.2 -34.38 68.46 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 123.359 0.664 . . . . 0.0 109.876 169.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -59.9 -12.29 7.37 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.189 1.396 . . . . 0.0 113.166 176.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -87.09 -32.22 20.05 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.618 1.099 . . . . 0.0 112.957 171.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -86.35 -43.81 12.58 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 122.794 0.438 . . . . 0.0 110.413 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.425 ' CD1' HG21 ' A' ' 144' ' ' ILE . 0.0 OUTLIER -86.66 119.25 71.2 Favored Pre-proline 0 CA--C 1.551 1.013 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 -178.06 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -82.66 -97.72 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.866 3.044 . . . . 0.0 112.225 -169.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -151.66 163.27 39.48 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.836 2.054 . . . . 0.0 106.756 173.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m 57.37 14.51 2.21 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.7 1.6 . . . . 0.0 112.226 -169.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.2 p -103.27 19.99 18.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.535 2.334 . . . . 0.0 112.354 -168.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.8 mt -133.74 141.35 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 169.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.8 m -156.93 149.45 23.34 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 169.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.7 t -113.48 133.56 59.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 103.793 -2.669 . . . . 0.0 103.793 169.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.2 mt -131.67 147.68 32.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -169.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -67.81 -44.64 76.82 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.814 -0.554 . . . . 0.0 110.604 177.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.7 m -165.47 148.55 7.95 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 -176.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.71 148.56 34.88 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 171.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.34 -37.48 83.47 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.109 0.564 . . . . 0.0 110.703 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -164.05 -179.21 6.06 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 127.078 2.151 . . . . 0.0 106.805 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 39.4 p-90 -66.48 -33.81 76.52 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 121.584 -0.698 . . . . 0.0 111.812 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.468 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 49.2 mt-30 -54.52 -51.08 66.29 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 169.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.37 -31.78 72.77 Favored 'General case' 0 C--O 1.222 -0.382 0 O-C-N 121.842 -0.536 . . . . 0.0 111.411 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.8 87.55 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 121.853 -0.529 . . . . 0.0 109.812 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.4 -45.68 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -57.92 -45.59 86.31 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.981 0.512 . . . . 0.0 110.423 -174.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -66.68 -32.26 73.46 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.778 -1.106 . . . . 0.0 111.815 173.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.3 m -61.42 -24.89 66.84 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 120.023 1.283 . . . . 0.0 111.675 173.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 9.3 mmt -120.13 -19.81 7.62 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -169.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.8 p -61.03 -34.15 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 CA-C-N 121.571 1.987 . . . . 0.0 112.212 -171.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.4 m -64.78 -30.11 71.11 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.245 0.929 . . . . 0.0 111.354 178.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.2 mt -74.57 -44.26 51.74 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.97 0.908 . . . . 0.0 108.584 172.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.4 tp -56.76 -40.17 75.34 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.881 0.872 . . . . 0.0 110.96 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -66.64 -30.59 70.89 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.116 1.367 . . . . 0.0 113.049 -173.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -98.81 14.71 27.86 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.001 0.364 . . . . 0.0 110.764 172.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.454 0.0 OUTLIER 44.9 43.62 7.22 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.183 2.193 . . . . 0.0 115.357 -169.636 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.478 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 30.6 m-85 -66.44 -19.75 65.88 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.509 -0.745 . . . . 0.0 109.489 168.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.1 pt -143.91 171.2 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 127.152 2.181 . . . . 0.0 108.585 -176.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.0 m -103.78 159.22 15.82 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.065 1.746 . . . . 0.0 107.52 169.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -59.87 -32.44 70.71 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.113 -0.992 . . . . 0.0 111.623 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -57.51 -34.96 69.65 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.12 0.568 . . . . 0.0 112.0 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -59.78 -40.84 89.61 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.72 0.808 . . . . 0.0 110.643 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.408 HG22 ' HE3' ' A' ' 47' ' ' LYS . 13.2 mt -63.73 -49.88 80.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.426 1.09 . . . . 0.0 108.599 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -66.14 -28.5 68.84 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 118.59 -0.719 . . . . 0.0 112.479 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.19 -43.16 78.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 118.82 0.736 . . . . 0.0 110.684 173.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 52.2 mt -69.26 -47.16 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.468 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.6 mttt -62.43 -43.87 97.78 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.373 0.533 . . . . 0.0 111.051 -173.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -66.61 -40.85 89.03 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.237 1.015 . . . . 0.0 110.757 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 18.3 m -63.98 -34.5 78.12 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.938 -0.476 . . . . 0.0 110.415 174.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 92.3 m . . . . . 0 CA--C 1.537 0.446 0 C-N-CA 123.752 0.821 . . . . 0.0 110.805 175.844 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 . . . . . 0 N--CA 1.462 0.169 0 CA-C-O 119.853 -0.118 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.1 mm -127.13 137.29 58.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 172.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -121.54 -31.17 4.08 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.309 0.644 . . . . 0.0 111.55 -170.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.56 160.1 27.95 Favored Pre-proline 0 C--O 1.236 0.343 0 C-N-CA 125.443 1.497 . . . . 0.0 107.046 176.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -50.92 113.31 1.03 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.53 2.153 . . . . 0.0 109.66 169.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 101.52 -6.19 55.2 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-O 117.528 -1.707 . . . . 0.0 114.538 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.4 t -130.45 127.49 62.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 120.036 1.918 . . . . 0.0 110.051 -169.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.62 166.33 16.91 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 126.214 1.805 . . . . 0.0 109.899 176.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.405 ' CE ' HD11 ' A' ' 118' ' ' LEU . 2.0 ttm -140.53 60.33 13.64 Favored Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 176.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 141.0 59.21 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.824 1.683 . . . . 0.0 113.755 -171.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -177.02 153.88 1.03 Allowed 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 128.537 2.735 . . . . 0.0 106.176 -170.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.82 160.52 38.3 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 126.41 1.884 . . . . 0.0 107.46 172.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.3 mtm105 -55.32 143.89 53.92 Favored Pre-proline 0 CA--C 1.535 0.398 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.838 177.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -45.94 -41.36 20.56 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.721 2.947 . . . . 0.0 113.335 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -61.77 -13.53 24.39 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.052 1.341 . . . . 0.0 113.288 -176.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 62.6 m -76.3 -3.99 39.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.463 0.705 . . . . 0.0 111.785 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.92 18.19 2.16 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.236 -1.313 . . . . 0.0 112.941 175.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.55 147.1 53.97 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 119.529 1.665 . . . . 0.0 109.107 169.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.4 mt -129.71 -29.74 2.12 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.356 1.062 . . . . 0.0 111.045 -173.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.478 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 87.9 mttt -143.58 157.78 44.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 125.707 1.603 . . . . 0.0 107.739 175.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.7 m -88.84 126.09 35.21 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.79 -178.4 39.79 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.019 0.819 . . . . 0.0 111.793 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 50.2 mtp -143.77 169.22 18.18 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 125.37 1.468 . . . . 0.0 111.132 -176.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.1 m -155.61 162.96 40.53 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.861 1.264 . . . . 0.0 109.444 169.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 mp -124.92 136.45 53.78 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 128.108 2.563 . . . . 0.0 107.141 -177.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 88.0 m -134.28 136.29 43.45 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 175.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.2 tp -129.06 144.59 51.24 Favored 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 123.346 0.404 . . . . 0.0 110.248 171.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -114.24 143.48 44.77 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.139 1.375 . . . . 0.0 109.735 174.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -74.95 -33.31 61.92 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 168.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -125.43 94.91 4.28 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.567 1.947 . . . . 0.0 107.324 174.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -56.81 162.35 7.06 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.188 0.899 . . . . 0.0 112.589 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 92.7 t -130.78 145.99 34.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 -173.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -105.21 172.27 6.88 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.733 0.813 . . . . 0.0 109.374 -174.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 . . . . . 0 CA--C 1.535 0.379 0 C-N-CA 124.718 1.207 . . . . 0.0 113.202 -169.385 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo . . . . . 0 N--CA 1.449 -1.137 0 N-CA-C 110.58 -0.584 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 39.9 mm -105.36 123.85 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -91.08 -22.63 20.63 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.291 -1.337 . . . . 0.0 111.043 170.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 40.7 tp -132.07 128.7 38.77 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.293 1.406 . . . . 0.0 110.649 -169.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.4 mp -132.02 138.05 48.07 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -178.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 6.0 mt -123.43 107.53 19.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -71.23 147.99 43.47 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 174.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.414 HD12 HD21 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -144.57 135.45 24.93 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 169.75 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.9 p -129.4 148.28 51.3 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 125.751 1.62 . . . . 0.0 106.793 168.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.84 133.24 21.85 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 118.88 0.764 . . . . 0.0 109.568 -177.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.71 -20.09 61.28 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.892 0.477 . . . . 0.0 111.878 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -147.58 152.62 38.25 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.381 1.072 . . . . 0.0 109.364 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.86 -32.87 71.09 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -175.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -77.9 -30.45 50.7 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 119.416 1.007 . . . . 0.0 111.32 178.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 7.9 m -64.76 -37.17 86.7 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.739 -0.6 . . . . 0.0 109.983 169.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -47.07 86.55 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 124.063 0.945 . . . . 0.0 110.185 170.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.5 mm -58.37 -49.45 81.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -57.39 -41.68 93.31 Favored Glycine 0 CA--C 1.532 1.103 0 CA-C-N 118.97 0.805 . . . . 0.0 111.924 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.28 -45.67 65.86 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.524 0.73 . . . . 0.0 111.213 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.0 mm -55.08 -46.71 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 124.86 1.264 . . . . 0.0 108.02 174.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -68.41 -9.87 51.35 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.422 1.089 . . . . 0.0 112.348 -177.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -95.95 -43.22 7.91 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 124.593 1.157 . . . . 0.0 110.834 171.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.414 HD21 HD12 ' A' ' 103' ' ' LEU . 4.4 pp -76.05 -26.62 56.73 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 118.376 0.534 . . . . 0.0 111.407 -175.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.6 p -59.4 -21.98 60.73 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.089 173.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -65.61 -20.4 66.3 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.137 0.881 . . . . 0.0 110.182 172.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 23.1 mt -102.2 -60.86 1.47 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.319 1.447 . . . . 0.0 111.037 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.79 -31.9 68.83 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.986 1.314 . . . . 0.0 113.802 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 59.6 m -104.58 26.74 8.67 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 118.641 0.655 . . . . 0.0 110.74 -174.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -132.29 97.9 4.25 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.0 -28.11 55.77 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.572 0.749 . . . . 0.0 112.263 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -65.61 -44.02 87.85 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.07 0.548 . . . . 0.0 110.142 176.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.64 -42.54 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 123.595 0.758 . . . . 0.0 108.998 175.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 62.2 mt -55.24 -43.87 74.98 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-O 118.711 -0.662 . . . . 0.0 110.595 -177.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -65.96 -40.8 91.62 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 118.605 0.639 . . . . 0.0 110.787 178.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.497 ' HB3' HD11 ' A' ' 143' ' ' ILE . 47.6 mt-30 -69.97 -29.0 66.0 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.504 0.593 . . . . 0.0 110.877 -175.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 34.5 mt -75.77 -52.73 9.78 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.942 0.897 . . . . 0.0 109.195 169.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 38.5 mt -57.61 -20.66 34.35 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.97 0.908 . . . . 0.0 113.294 -176.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 76.4 p -114.25 10.85 17.3 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.679 1.192 . . . . 0.0 111.249 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.98 110.92 1.48 Allowed 'General case' 0 C--N 1.344 0.35 0 C-N-CA 124.167 0.987 . . . . 0.0 110.287 -179.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 10.5 m -74.67 -10.84 59.91 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.567 0.747 . . . . 0.0 112.157 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 3.6 p -158.1 152.64 24.72 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.997 0.817 . . . . 0.0 108.997 -172.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -59.26 -34.96 72.87 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.634 1.174 . . . . 0.0 110.774 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -35.21 60.15 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 124.561 1.144 . . . . 0.0 113.819 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -73.14 -34.92 66.38 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 123.447 0.699 . . . . 0.0 110.173 -177.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 mp -61.9 -46.31 89.93 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-N 119.978 1.263 . . . . 0.0 109.019 172.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.71 -29.93 71.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.479 0.712 . . . . 0.0 112.637 177.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -68.63 -44.85 73.35 Favored 'General case' 0 C--N 1.332 -0.163 0 O-C-N 121.169 -0.957 . . . . 0.0 110.421 174.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.497 HD11 ' HB3' ' A' ' 130' ' ' GLN . 68.8 mt -62.34 -38.58 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 C-N-CA 124.229 1.011 . . . . 0.0 109.884 177.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . 0.425 HG21 ' CD1' ' A' ' 7' ' ' PHE . 12.7 mm -55.79 -56.15 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.062 0 C-N-CA 123.722 0.809 . . . . 0.0 109.289 169.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 40.7 m -64.36 -26.46 68.48 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.887 0.475 . . . . 0.0 111.279 -170.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -58.94 -27.88 65.72 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.836 1.654 . . . . 0.0 113.362 173.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.936 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 -173.957 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.2 tpp . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.96 114.52 3.12 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 168.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -56.92 -43.57 81.55 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.978 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.97 -26.37 14.99 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.407 1.483 . . . . 0.0 112.955 -176.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -59.43 -28.55 67.05 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 118.888 0.767 . . . . 0.0 111.971 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -91.21 -12.56 34.94 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 117.545 -1.217 . . . . 0.0 112.859 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -114.02 85.66 10.35 Favored Pre-proline 0 N--CA 1.473 0.703 0 CA-C-N 121.607 2.003 . . . . 0.0 107.832 -173.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -57.92 -53.64 4.15 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.224 2.616 . . . . 0.0 116.412 -169.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.523 ' C ' ' H ' ' A' ' 11' ' ' SER . 41.6 tt0 -159.64 -88.3 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.041 0.837 . . . . 0.0 113.191 -169.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.9 m -68.77 16.23 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.884 1.674 . . . . 0.0 111.162 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.523 ' H ' ' C ' ' A' ' 9' ' ' GLU . 8.7 m -76.92 10.08 2.51 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 128.174 2.589 . . . . 0.0 112.785 -168.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.6 mm -139.4 130.11 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 N-CA-C 104.071 -2.566 . . . . 0.0 104.071 -171.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.6 m -157.24 136.39 11.86 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 119.625 1.102 . . . . 0.0 110.621 171.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.6 p -106.03 139.66 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 168.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.8 mt -135.89 143.86 35.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 124.255 1.022 . . . . 0.0 108.315 -168.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 39.6 m80 -67.95 -35.22 78.02 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.925 0.49 . . . . 0.0 111.959 177.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -174.42 144.23 0.89 Allowed 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.201 1.8 . . . . 0.0 106.431 176.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.411 ' HB3' HG21 ' A' ' 88' ' ' VAL . . . -80.3 150.24 30.04 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 169.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -59.41 -41.29 89.16 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.127 0.571 . . . . 0.0 110.977 -178.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -167.16 -176.24 3.25 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 126.531 1.933 . . . . 0.0 108.052 172.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 24.1 p-90 -68.69 -30.73 69.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.897 0.771 . . . . 0.0 112.817 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.504 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.0 mt-30 -60.83 -47.51 86.01 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 171.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.87 -35.71 79.12 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 121.201 -0.937 . . . . 0.0 111.666 176.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.0 -34.07 77.17 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.881 -0.512 . . . . 0.0 110.65 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.72 -46.52 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 171.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -56.46 -46.59 80.3 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 118.227 0.467 . . . . 0.0 110.331 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -62.98 -34.34 77.33 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 117.98 -1.01 . . . . 0.0 111.561 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.2 m -63.85 -21.72 66.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.937 1.244 . . . . 0.0 112.484 174.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.0 mmt -123.51 -17.58 6.44 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -169.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -58.25 -35.4 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 120.3 1.409 . . . . 0.0 112.399 -169.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 m -60.48 -36.19 77.7 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 119.217 0.917 . . . . 0.0 110.819 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.6 mt -78.62 -40.44 34.33 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.152 0.981 . . . . 0.0 109.199 178.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 43.0 tp -56.99 -40.97 77.55 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.337 0.517 . . . . 0.0 110.24 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -68.11 -32.44 72.75 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 124.733 1.213 . . . . 0.0 113.252 -172.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -96.68 17.89 15.49 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.31 0.505 . . . . 0.0 110.672 172.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.43 0.0 OUTLIER 44.18 40.85 3.83 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.579 2.351 . . . . 0.0 115.979 -171.27 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -66.71 -20.4 65.96 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.195 -0.941 . . . . 0.0 109.372 167.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.7 pt -143.57 168.87 11.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 C-N-CA 126.928 2.091 . . . . 0.0 108.419 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 64.4 p -101.13 165.88 11.07 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.831 1.252 . . . . 0.0 108.889 169.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.4 -30.29 70.46 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.266 -0.897 . . . . 0.0 111.86 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -59.46 -33.68 71.59 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 121.931 -0.481 . . . . 0.0 111.604 177.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -59.84 -41.68 91.92 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.344 0.658 . . . . 0.0 111.199 -177.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.6 mp -59.26 -49.51 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -67.36 -29.17 68.64 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 121.61 -0.681 . . . . 0.0 112.757 -178.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.11 -43.48 78.19 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.688 0.676 . . . . 0.0 110.907 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 51.1 mt -69.36 -44.75 80.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 178.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.504 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.8 mttt -63.22 -41.08 99.08 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.611 -0.681 . . . . 0.0 111.077 -176.197 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.16 -39.61 94.36 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.316 1.046 . . . . 0.0 110.623 176.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.0 m -62.59 -36.86 84.05 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.996 -0.44 . . . . 0.0 110.539 172.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 23.9 m . . . . . 0 CA--C 1.537 0.478 0 C-N-CA 123.479 0.712 . . . . 0.0 110.39 177.95 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 . . . . . 0 N--CA 1.449 -0.514 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.6 mm -133.16 140.38 47.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -114.84 -31.62 6.06 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.025 0.53 . . . . 0.0 111.164 175.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -156.45 158.56 31.5 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 125.469 1.508 . . . . 0.0 107.376 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.12 124.09 9.76 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.473 2.115 . . . . 0.0 110.104 169.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.66 -0.08 88.01 Favored Glycine 0 CA--C 1.537 1.417 0 CA-C-O 117.791 -1.561 . . . . 0.0 115.077 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.3 t -127.78 111.08 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 119.986 1.893 . . . . 0.0 108.033 -176.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -107.74 167.65 9.82 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 123.881 0.872 . . . . 0.0 110.027 174.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.4 ttm -141.05 61.58 14.68 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 176.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -52.17 143.04 43.57 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 121.901 1.734 . . . . 0.0 113.902 -171.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -178.4 154.33 0.8 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 128.472 2.709 . . . . 0.0 106.388 -170.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -136.65 153.28 50.96 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.961 1.704 . . . . 0.0 107.621 169.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 38.2 mtm105 -53.56 143.16 38.81 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.33 -178.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -45.5 -43.17 18.05 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.901 3.067 . . . . 0.0 114.145 -171.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.2 -13.53 18.81 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.687 1.195 . . . . 0.0 113.975 -177.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.1 m -75.88 -7.15 53.85 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.774 0.83 . . . . 0.0 111.954 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 135.75 14.21 1.03 Allowed Glycine 0 CA--C 1.525 0.705 0 CA-C-O 118.434 -1.203 . . . . 0.0 113.547 177.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.87 144.79 52.41 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 119.904 1.852 . . . . 0.0 109.304 169.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.5 mt -129.68 -32.71 1.89 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 124.854 1.261 . . . . 0.0 110.479 -173.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -143.39 164.76 29.38 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 126.149 1.78 . . . . 0.0 107.968 174.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.6 m -97.07 130.94 44.3 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 123.218 0.607 . . . . 0.0 110.587 -178.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.46 -179.07 45.77 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 124.954 1.264 . . . . 0.0 110.737 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 47.1 mtt -143.9 171.09 14.71 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 126.46 1.904 . . . . 0.0 110.706 -175.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.85 161.7 41.3 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 126.427 1.891 . . . . 0.0 107.872 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.3 tp -141.54 117.56 10.57 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.336 1.855 . . . . 0.0 107.274 -172.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 69.6 m -123.37 141.72 51.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.423 HD11 ' HA ' ' A' ' 132' ' ' LEU . 13.9 tp -133.25 146.35 51.34 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 171.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.17 135.61 53.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.368 1.067 . . . . 0.0 108.573 174.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.05 -40.55 87.14 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 168.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -123.06 94.01 4.13 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.758 2.023 . . . . 0.0 106.825 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -53.93 160.98 4.02 Favored Glycine 0 CA--C 1.526 0.754 0 C-N-CA 124.885 1.231 . . . . 0.0 113.491 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.411 HG21 ' HB3' ' A' ' 18' ' ' ALA . 76.0 t -123.73 149.87 27.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -112.21 108.64 17.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.079 0.466 . . . . 0.0 111.832 -167.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 169.147 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo . . . . . 0 N--CA 1.46 -0.453 0 CA-C-O 120.819 0.258 . . . . 0.0 111.809 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 26.4 mm -72.79 128.55 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 175.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -104.74 -15.38 15.25 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 117.239 -1.363 . . . . 0.0 111.134 170.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 48.9 tp -141.1 132.11 26.16 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 120.467 1.485 . . . . 0.0 109.645 -171.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.8 mp -137.47 132.43 33.32 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.657 ' HB ' HD11 ' A' ' 122' ' ' LEU . 3.0 mt -112.94 117.21 54.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 168.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.51 147.41 35.62 Favored Glycine 0 N--CA 1.443 -0.852 0 N-CA-C 108.465 -1.854 . . . . 0.0 108.465 169.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.445 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -141.95 138.65 32.11 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 103.277 -2.86 . . . . 0.0 103.277 169.088 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.445 ' N ' HD23 ' A' ' 103' ' ' LEU . 5.2 m -140.71 143.99 35.34 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 169.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.23 136.96 26.98 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 118.399 0.545 . . . . 0.0 109.734 -169.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.92 -22.05 59.82 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.03 0.532 . . . . 0.0 112.097 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -146.31 155.54 42.71 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.973 0.909 . . . . 0.0 109.758 -178.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.43 74.29 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -177.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.59 -31.58 62.08 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 120.807 -1.183 . . . . 0.0 110.946 177.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.7 m -64.49 -39.33 93.6 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.993 -0.442 . . . . 0.0 110.161 170.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.9 t60 -58.8 -48.84 79.87 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 123.541 0.737 . . . . 0.0 110.054 171.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 12.2 mm -56.01 -53.02 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.472 0.709 . . . . 0.0 109.168 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.24 -39.35 94.47 Favored Glycine 0 CA--C 1.529 0.966 0 CA-C-N 118.931 0.787 . . . . 0.0 111.929 -177.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.84 -53.48 21.18 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.506 1.122 . . . . 0.0 110.64 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.3 mm -49.89 -47.54 22.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 125.746 1.619 . . . . 0.0 108.883 173.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -67.72 -10.95 57.02 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.427 -0.795 . . . . 0.0 112.384 -177.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.35 -48.33 6.72 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.146 0.979 . . . . 0.0 109.509 170.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.481 HD12 ' N ' ' A' ' 119' ' ' SER . 1.9 pp -70.33 -22.73 62.77 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -176.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . 0.481 ' N ' HD12 ' A' ' 118' ' ' LEU . 44.2 m -63.18 -23.24 67.34 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 123.522 0.729 . . . . 0.0 111.475 173.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -66.84 -17.45 64.89 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.522 -0.736 . . . . 0.0 110.122 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 38.0 mt -108.1 -61.87 1.52 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.822 1.249 . . . . 0.0 110.951 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.657 HD11 ' HB ' ' A' ' 101' ' ' ILE . 72.8 mt -69.63 -8.62 49.14 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.21 1.404 . . . . 0.0 114.206 -173.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.1 m -120.09 27.68 8.51 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.843 0.857 . . . . 0.0 110.64 175.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -131.44 101.62 5.6 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 125.316 1.446 . . . . 0.0 107.515 176.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -56.8 -27.62 60.13 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.657 0.783 . . . . 0.0 112.217 -177.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -63.13 -48.53 78.12 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 123.465 0.706 . . . . 0.0 109.789 176.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.28 -43.26 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 C-N-CA 123.945 0.898 . . . . 0.0 109.016 177.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.46 HD21 ' HA ' ' A' ' 122' ' ' LEU . 47.5 mt -55.73 -43.2 76.34 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.989 -175.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -66.99 -38.9 86.87 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.479 0.581 . . . . 0.0 110.711 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -70.97 -34.7 71.68 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 118.78 0.718 . . . . 0.0 109.863 -175.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 35.1 mt -67.91 -54.35 19.49 Favored 'General case' 0 C--O 1.224 -0.27 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 170.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . 0.423 ' HA ' HD11 ' A' ' 83' ' ' LEU . 29.5 mt -56.57 -23.61 41.59 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -175.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 69.6 p -109.45 5.62 23.51 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.434 1.093 . . . . 0.0 111.876 -178.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.03 106.33 0.82 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 124.271 1.028 . . . . 0.0 110.68 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.5 p -75.55 -1.86 26.38 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.033 1.333 . . . . 0.0 112.999 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 21.4 p -149.78 155.4 40.05 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.04 0.936 . . . . 0.0 110.714 -177.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -58.62 -39.28 80.03 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.506 1.122 . . . . 0.0 109.577 173.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -34.26 74.93 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.06 -178.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -63.17 -44.14 96.3 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.603 0.638 . . . . 0.0 110.941 174.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.6 mt -63.54 -49.07 74.9 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.56 -35.13 71.87 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 173.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -66.74 -43.09 85.11 Favored 'General case' 0 C--N 1.331 -0.197 0 O-C-N 120.962 -1.086 . . . . 0.0 109.86 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 82.9 mt -66.75 -35.16 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 C-N-CA 123.661 0.784 . . . . 0.0 109.199 179.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.1 mm -58.54 -53.14 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 169.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 25.3 m -63.0 -28.76 70.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 122.747 0.419 . . . . 0.0 111.61 -171.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -60.01 -28.28 67.59 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 126.212 1.805 . . . . 0.0 113.565 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.869 0 CA-C-O 117.935 -1.481 . . . . 0.0 109.5 -173.245 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.222 0.058 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -66.21 110.21 2.93 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 173.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -59.46 -32.63 70.41 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 171.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.58 -18.47 11.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.103 0.961 . . . . 0.0 112.443 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -66.09 -22.45 66.4 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 118.883 0.765 . . . . 0.0 112.772 176.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -102.76 -4.85 24.38 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 117.039 -1.458 . . . . 0.0 114.215 -169.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -116.16 88.07 21.43 Favored Pre-proline 0 N--CA 1.475 0.815 0 CA-C-N 122.116 2.234 . . . . 0.0 109.245 -170.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_exo -40.65 -73.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.808 1 C-N-CA 125.723 4.282 . . . . 0.0 116.448 -174.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.448 ' C ' ' H ' ' A' ' 11' ' ' SER . 37.2 tt0 -163.32 -76.72 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.832 0.853 . . . . 0.0 111.252 -171.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.67 6.8 0.58 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.774 1.63 . . . . 0.0 111.914 175.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . 0.448 ' H ' ' C ' ' A' ' 9' ' ' GLU . 3.5 m -73.94 -0.85 17.43 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.571 2.348 . . . . 0.0 113.626 -168.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.6 mt -133.48 134.5 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 -169.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.7 m -156.41 151.71 26.62 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.496 0.718 . . . . 0.0 110.939 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.9 t -118.74 142.22 34.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 169.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.421 HG22 ' H ' ' A' ' 17' ' ' SER . 15.3 mt -139.41 147.69 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.227 1.811 . . . . 0.0 106.216 -171.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -68.65 -45.54 71.5 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.231 -0.918 . . . . 0.0 110.375 169.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.421 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -170.6 145.95 2.63 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.918 1.687 . . . . 0.0 106.455 -177.861 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.29 159.22 27.32 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 174.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt -59.09 -35.7 73.86 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.404 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -164.6 -179.28 5.84 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 127.328 2.251 . . . . 0.0 106.8 170.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 41.8 p-90 -64.97 -33.78 76.86 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.209 -0.932 . . . . 0.0 112.194 171.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.443 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 48.8 mt-30 -55.27 -45.23 76.15 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.75 1.22 . . . . 0.0 108.485 170.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -71.04 -33.56 70.41 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 121.23 -0.919 . . . . 0.0 110.817 177.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.42 -35.08 79.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 121.573 -0.704 . . . . 0.0 110.786 -178.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.94 -47.07 86.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 170.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.46 -42.24 82.13 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 118.469 0.577 . . . . 0.0 110.604 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -64.68 -33.1 75.16 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.167 0.987 . . . . 0.0 111.614 173.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.9 m -67.16 -17.97 65.07 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.831 1.196 . . . . 0.0 112.03 173.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.1 mmt -125.57 -23.48 4.06 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -168.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 p -60.25 -36.91 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 120.837 1.653 . . . . 0.0 111.684 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.0 m -67.16 -19.54 65.61 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 118.594 0.634 . . . . 0.0 112.119 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 79.9 mt -86.33 -43.46 12.86 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.908 0.883 . . . . 0.0 109.115 169.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 35.8 tp -56.61 -43.2 79.94 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.92 0.888 . . . . 0.0 110.66 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -67.65 -23.49 65.34 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 125.865 1.666 . . . . 0.0 113.931 -171.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -114.49 26.1 10.5 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.057 0.389 . . . . 0.0 110.592 171.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 60.82 26.38 16.22 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 170.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.405 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 68.0 m-85 -66.97 -23.05 65.9 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.165 -0.959 . . . . 0.0 110.647 169.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.5 pt -142.06 179.61 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 126.702 2.001 . . . . 0.0 107.975 178.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.8 p -123.17 162.65 22.13 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.816 1.646 . . . . 0.0 108.727 170.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.05 -31.68 67.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.06 0.944 . . . . 0.0 113.076 -169.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -60.16 -33.5 72.27 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.746 -0.596 . . . . 0.0 111.794 177.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -59.48 -41.51 89.97 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.722 0.809 . . . . 0.0 110.647 -177.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.12 -52.09 64.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 123.446 0.699 . . . . 0.0 109.552 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -68.9 -26.84 65.3 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -176.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.71 -41.37 73.71 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.024 0.829 . . . . 0.0 111.03 173.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 33.5 mt -70.29 -45.65 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.443 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.5 mttt -66.64 -39.9 88.47 Favored 'General case' 0 C--O 1.224 -0.266 0 O-C-N 121.989 -0.444 . . . . 0.0 111.445 -175.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.45 -41.43 98.73 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.24 1.016 . . . . 0.0 110.301 178.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -64.83 -40.85 95.84 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.411 0.684 . . . . 0.0 110.508 173.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 27.8 m . . . . . 0 CA--C 1.54 0.579 0 O-C-N 121.606 -0.684 . . . . 0.0 111.2 174.661 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 . . . . . 0 N--CA 1.454 -0.231 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.5 mm -138.24 134.19 44.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 104.77 -2.308 . . . . 0.0 104.77 -174.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -123.71 -28.5 3.84 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 123.468 0.707 . . . . 0.0 111.261 -169.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.22 162.91 23.16 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 125.717 1.607 . . . . 0.0 107.322 175.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.1 117.98 3.22 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.694 2.263 . . . . 0.0 110.893 169.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.85 1.01 77.42 Favored Glycine 0 CA--C 1.53 0.97 0 CA-C-O 117.931 -1.483 . . . . 0.0 114.064 178.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.3 t -128.9 118.91 48.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 119.803 1.801 . . . . 0.0 108.698 -169.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -121.31 166.89 13.39 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.554 1.542 . . . . 0.0 110.104 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.0 ttm -135.8 60.63 37.1 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 123.166 0.586 . . . . 0.0 110.163 172.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -59.3 121.22 9.54 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 121.946 1.764 . . . . 0.0 110.15 -171.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -172.5 162.49 5.28 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 127.634 2.374 . . . . 0.0 107.173 -169.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.87 172.42 13.04 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.709 1.204 . . . . 0.0 109.867 -174.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -58.5 154.01 36.28 Favored Pre-proline 0 CA--C 1.537 0.467 0 CA-C-O 118.468 -0.777 . . . . 0.0 109.605 173.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.55 -40.03 83.74 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.462 2.108 . . . . 0.0 109.972 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -64.61 -12.59 47.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.402 1.481 . . . . 0.0 112.94 -176.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 80.9 m -77.34 -5.37 49.35 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.777 0.717 . . . . 0.0 111.965 178.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 130.69 18.44 1.41 Allowed Glycine 0 CA--C 1.524 0.607 0 CA-C-O 118.405 -1.219 . . . . 0.0 113.112 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.09 146.07 53.81 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 119.281 1.541 . . . . 0.0 109.026 169.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.8 mt -132.77 -29.47 1.5 Allowed 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 123.973 0.909 . . . . 0.0 111.183 -173.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.405 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 64.5 mttt -147.17 156.15 42.73 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.031 1.332 . . . . 0.0 107.827 177.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 93.7 m -88.28 128.57 35.48 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 123.04 0.536 . . . . 0.0 111.057 -176.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -176.92 -178.8 46.95 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.347 1.451 . . . . 0.0 110.854 -176.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.659 ' SD ' HD21 ' A' ' 118' ' ' LEU . 53.5 mtt -148.57 172.46 14.49 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 127.018 2.127 . . . . 0.0 110.077 -175.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.7 m -152.75 168.21 26.45 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.209 1.403 . . . . 0.0 109.157 169.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.421 HD22 HD11 ' A' ' 144' ' ' ILE . 12.9 tp -145.59 125.51 13.56 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.448 1.899 . . . . 0.0 108.737 -169.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 73.2 m -133.56 145.33 49.99 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.974 1.31 . . . . 0.0 108.296 -176.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.472 HD23 ' N ' ' A' ' 84' ' ' LEU . 5.6 tt -136.29 132.77 36.16 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 174.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.472 ' N ' HD23 ' A' ' 83' ' ' LEU . 9.2 mp -114.09 121.31 43.44 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 126.865 2.066 . . . . 0.0 106.376 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -60.77 -36.91 80.17 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.247 0.93 . . . . 0.0 112.745 -177.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -92.96 -14.93 26.86 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.286 0.634 . . . . 0.0 112.156 176.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.97 -176.44 21.67 Favored Glycine 0 CA--C 1.534 1.271 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 -168.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.2 p -150.66 164.43 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 O-C-N 121.663 -0.904 . . . . 0.0 108.659 169.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -102.37 110.71 22.74 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.458 0.647 . . . . 0.0 109.837 -169.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 . . . . . 0 CA--C 1.539 0.534 0 C-N-CA 125.594 1.558 . . . . 0.0 108.118 170.148 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo . . . . . 0 N--CA 1.452 -0.966 0 N-CA-C 109.22 -1.108 . . . . 0.0 109.22 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 31.4 mm -72.38 107.74 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 178.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 32.0 mtpt -84.59 -18.86 34.2 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-O 117.094 -1.431 . . . . 0.0 111.513 171.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 8.4 mt -137.97 139.24 39.6 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 120.703 1.592 . . . . 0.0 111.837 -174.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mp -140.7 134.63 30.63 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 -175.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.64 HG21 HD22 ' A' ' 118' ' ' LEU . 5.0 mt -119.94 126.49 75.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 169.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.18 153.58 28.01 Favored Glycine 0 CA--C 1.522 0.517 0 N-CA-C 108.834 -1.706 . . . . 0.0 108.834 169.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.516 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -149.99 144.26 25.72 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 105.344 -2.095 . . . . 0.0 105.344 173.877 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.516 ' N ' HD23 ' A' ' 103' ' ' LEU . 79.5 p -142.29 146.38 35.01 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 105.565 -2.013 . . . . 0.0 105.565 168.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.665 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -144.15 148.17 34.67 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 171.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -83.78 -13.85 52.88 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.012 -174.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -135.5 152.53 51.42 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.619 0.768 . . . . 0.0 110.171 174.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.27 -35.23 76.73 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -177.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -72.22 -31.17 65.61 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.09 -1.006 . . . . 0.0 110.808 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.505 ' HB2' ' HB1' ' A' ' 105' ' ' ALA . 16.3 m -63.84 -38.82 92.52 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 118.719 -0.658 . . . . 0.0 109.658 169.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.665 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 24.8 m-70 -61.93 -43.33 99.07 Favored 'General case' 0 C--N 1.344 0.345 0 CA-C-N 119.401 1.0 . . . . 0.0 110.767 172.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.8 mm -57.82 -55.57 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 119.428 1.013 . . . . 0.0 109.331 177.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -58.92 -39.32 93.92 Favored Glycine 0 CA--C 1.528 0.849 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.435 ' CB ' HD21 ' A' ' 103' ' ' LEU . . . -67.51 -49.05 65.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.308 1.043 . . . . 0.0 111.267 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.4 mm -56.36 -42.95 75.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.231 1.013 . . . . 0.0 108.643 176.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -70.98 -12.35 61.49 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.75 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -82.98 -45.51 14.01 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 169.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.659 HD21 ' SD ' ' A' ' 79' ' ' MET . 92.5 mt -71.54 -26.94 62.85 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 118.887 -0.578 . . . . 0.0 112.062 -174.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.1 m -60.83 -24.43 65.86 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.096 0.407 . . . . 0.0 111.591 170.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.53 -16.41 62.33 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.748 -1.22 . . . . 0.0 110.688 175.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 42.2 mt -104.52 -67.56 0.9 Allowed 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.322 1.049 . . . . 0.0 109.713 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 16.9 mt -75.48 -6.35 49.71 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -171.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 33.4 m -119.86 29.7 7.42 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.175 0.898 . . . . 0.0 110.457 174.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -131.33 108.5 9.69 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 172.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -57.68 -27.38 62.83 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.632 -177.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -63.78 -45.25 90.6 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.25 0.62 . . . . 0.0 110.003 176.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.54 -41.23 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 118.409 -0.805 . . . . 0.0 109.135 175.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 35.3 mt -56.14 -39.78 72.78 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 119.34 0.973 . . . . 0.0 111.231 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -69.87 -37.33 76.05 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.01 176.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -65.35 -41.44 93.85 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 119.336 0.971 . . . . 0.0 109.106 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 22.9 mt -66.19 -52.85 44.12 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 175.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 51.1 mt -59.37 -17.4 29.66 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 77.6 p -108.24 3.2 23.36 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.629 1.172 . . . . 0.0 112.09 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.45 140.19 58.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.403 1.081 . . . . 0.0 109.257 169.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -132.46 1.84 3.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.028 1.331 . . . . 0.0 111.234 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.2 m -144.28 150.62 38.19 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.115 0.966 . . . . 0.0 109.442 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.2 -43.16 92.25 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.957 1.303 . . . . 0.0 110.649 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -60.02 -35.29 74.76 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 123.054 0.542 . . . . 0.0 111.287 177.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -64.56 -40.34 95.39 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.948 0.899 . . . . 0.0 111.161 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.1 mt -65.61 -46.15 80.4 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.31 69.27 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 174.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -65.57 -38.18 88.81 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 120.52 -1.363 . . . . 0.0 109.913 174.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 66.2 mt -69.55 -35.47 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 C-N-CA 124.141 0.976 . . . . 0.0 109.562 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . 0.421 HD11 HD22 ' A' ' 81' ' ' LEU . 27.9 mm -56.26 -50.75 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 169.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 18.7 m -65.12 -30.61 71.55 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 123.281 0.363 . . . . 0.0 110.966 -173.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -60.11 -27.61 67.17 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.218 1.407 . . . . 0.0 113.296 172.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 N-CA-C 108.79 -1.724 . . . . 0.0 108.79 -179.028 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.467 0.175 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.21 109.01 3.38 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 172.145 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -58.36 -31.69 67.85 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.6 -21.1 2.33 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.931 1.692 . . . . 0.0 113.319 177.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -64.02 -25.19 68.01 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.304 0.957 . . . . 0.0 113.468 174.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -101.19 -21.66 14.87 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -169.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -103.97 103.99 40.76 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 -170.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -59.19 -68.04 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.511 2.807 . . . . 0.0 113.968 -171.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -163.28 -74.73 0.04 OUTLIER 'General case' 0 CA--C 1.521 -0.164 0 C-N-CA 124.155 0.982 . . . . 0.0 111.028 -173.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.13 3.11 1.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.104 1.362 . . . . 0.0 111.917 177.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -15.28 63.5 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.815 1.646 . . . . 0.0 113.24 -169.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.4 mp -117.83 137.27 52.3 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 -171.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.1 m -156.97 139.86 15.26 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.572 0.624 . . . . 0.0 110.917 176.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 92.7 t -105.0 137.11 35.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 104.764 -2.31 . . . . 0.0 104.764 169.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 40.9 mt -137.74 148.81 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 -176.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -66.05 -45.82 79.99 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.584 -0.697 . . . . 0.0 110.733 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -164.9 144.39 6.98 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.815 1.246 . . . . 0.0 108.144 -176.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.23 156.75 28.0 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 169.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -60.05 -40.92 91.07 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.576 176.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -167.41 -177.49 3.63 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 128.201 2.6 . . . . 0.0 107.505 171.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -62.17 -34.15 75.88 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.479 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.5 mt-30 -60.66 -48.43 81.81 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.578 1.535 . . . . 0.0 107.906 173.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -62.64 -35.86 80.96 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 121.307 -0.871 . . . . 0.0 111.451 176.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.93 82.4 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.766 -0.584 . . . . 0.0 110.544 -178.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -65.64 -47.89 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 172.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -58.44 -48.02 82.08 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 118.434 0.561 . . . . 0.0 110.762 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -59.7 -30.01 68.49 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.287 1.035 . . . . 0.0 111.356 174.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 31.5 m -84.58 -9.91 57.87 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 119.383 0.992 . . . . 0.0 113.565 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.2 mmt -124.72 -21.52 4.78 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 119.99 1.268 . . . . 0.0 112.757 -172.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.22 -37.28 55.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 120.489 1.495 . . . . 0.0 111.125 -175.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 m -64.48 -25.71 68.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.598 -0.689 . . . . 0.0 112.425 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.6 mt -87.51 -40.98 13.83 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.127 0.971 . . . . 0.0 109.061 175.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.2 tp -56.15 -41.72 75.84 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.563 1.145 . . . . 0.0 110.4 176.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.67 -32.64 74.31 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 125.426 1.49 . . . . 0.0 112.673 -174.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.3 mmtt -94.69 15.84 17.21 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.217 0.462 . . . . 0.0 110.818 173.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.33 3.5 p30 46.89 42.57 12.36 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.889 1.675 . . . . 0.0 114.079 -172.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -69.88 -21.84 63.29 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.501 -0.749 . . . . 0.0 109.324 168.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.6 pt -147.12 170.43 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 127.096 2.158 . . . . 0.0 108.159 -174.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.8 p -105.85 168.13 9.32 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.039 1.336 . . . . 0.0 109.187 169.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.89 -30.06 71.18 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.254 -0.904 . . . . 0.0 111.997 -175.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -60.59 -32.55 71.65 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 121.788 -0.57 . . . . 0.0 111.474 175.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -59.88 -43.42 94.74 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.539 0.609 . . . . 0.0 110.563 -177.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.1 mp -55.33 -50.11 67.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 123.315 0.646 . . . . 0.0 109.365 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -71.43 -25.38 62.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.665 -0.683 . . . . 0.0 111.923 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.58 -43.82 97.85 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 119.434 1.015 . . . . 0.0 110.801 173.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.4 mt -63.99 -45.41 96.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.8 mttt -61.62 -37.98 85.96 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 122.042 -0.411 . . . . 0.0 110.229 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.45 -43.49 94.1 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 119.083 0.856 . . . . 0.0 111.33 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 49.4 m -59.12 -38.75 80.34 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.753 0.706 . . . . 0.0 110.611 171.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.5 m . . . . . 0 CA--C 1.539 0.524 0 C-N-CA 123.564 0.746 . . . . 0.0 111.064 178.194 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 . . . . . 0 C--O 1.231 0.108 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.5 mm -141.01 134.54 31.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 103.114 -2.921 . . . . 0.0 103.114 -178.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mp -130.62 -21.2 2.82 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -169.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.29 160.43 30.45 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 172.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -57.67 121.36 9.89 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 121.927 1.751 . . . . 0.0 109.565 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.54 2.53 76.08 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-O 117.895 -1.503 . . . . 0.0 114.445 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.7 t -133.39 118.67 32.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-N 120.312 2.056 . . . . 0.0 109.275 -169.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -116.19 163.35 16.1 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.362 1.465 . . . . 0.0 109.818 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 7.5 ttm -137.79 61.08 27.54 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-O 118.59 -0.719 . . . . 0.0 109.862 171.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . 0.28 93.7 Cg_exo -31.22 -85.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.016 1 C-N-CA 125.786 4.324 . . . . 0.0 118.763 -168.305 . . . . . . . . 3 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 54.72 164.13 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 126.905 2.082 . . . . 0.0 114.61 -176.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -141.97 155.87 45.46 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 126.478 1.911 . . . . 0.0 106.916 170.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -50.86 147.75 8.31 Favored Pre-proline 0 CA--C 1.536 0.42 0 CA-C-O 118.08 -0.962 . . . . 0.0 110.034 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_exo -46.68 -41.97 24.18 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.217 2.611 . . . . 0.0 112.876 176.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -61.6 -14.28 29.1 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.799 1.24 . . . . 0.0 113.842 -177.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.2 m -79.84 -3.08 46.31 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.712 0.805 . . . . 0.0 112.247 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.66 18.92 1.72 Allowed Glycine 0 C--N 1.336 0.562 0 CA-C-O 118.748 -1.029 . . . . 0.0 112.959 175.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.4 148.67 49.29 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 119.468 1.634 . . . . 0.0 109.269 170.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 76.5 mt -131.9 -32.25 1.45 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 124.828 1.251 . . . . 0.0 110.77 -175.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -143.31 163.15 33.79 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.942 1.697 . . . . 0.0 107.816 178.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.3 m -97.71 122.62 41.01 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 123.189 0.596 . . . . 0.0 109.91 -177.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -168.88 179.83 41.44 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.25 1.405 . . . . 0.0 111.348 -176.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.7 ' SD ' HD21 ' A' ' 118' ' ' LEU . 52.1 mtt -149.02 168.34 23.39 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.44 1.496 . . . . 0.0 111.23 -170.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.2 p -148.54 164.91 32.8 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.454 1.502 . . . . 0.0 109.852 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.523 HD22 HD11 ' A' ' 144' ' ' ILE . 21.1 tp -146.28 90.03 1.92 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.602 1.561 . . . . 0.0 109.923 -169.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.1 m -97.45 143.75 27.86 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.0 tp -133.25 136.78 45.76 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 169.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -115.69 116.34 27.91 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 104.705 -2.331 . . . . 0.0 104.705 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.42 -33.44 75.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 118.701 0.682 . . . . 0.0 112.328 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -85.48 -13.43 49.14 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.919 0.888 . . . . 0.0 111.722 173.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 68.75 177.23 13.7 Favored Glycine 0 CA--C 1.533 1.181 0 N-CA-C 110.265 -1.134 . . . . 0.0 110.265 -168.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -146.12 161.15 10.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 168.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.95 103.0 11.96 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 121.409 -0.807 . . . . 0.0 110.024 -169.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 . . . . . 0 CA--C 1.538 0.497 0 CA-C-N 114.924 -1.035 . . . . 0.0 109.097 170.775 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo . . . . . 0 CA--C 1.534 0.524 0 N-CA-C 114.041 0.746 . . . . 0.0 114.041 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 27.0 mm -108.1 123.5 63.68 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -89.05 -32.52 17.53 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-O 116.819 -1.562 . . . . 0.0 109.878 169.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.46 HD22 HD22 ' A' ' 131' ' ' LEU . 1.9 tp -130.49 144.09 51.18 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 121.1 1.773 . . . . 0.0 112.297 -172.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.3 mp -132.95 109.16 9.38 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.008 1.323 . . . . 0.0 107.707 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.724 HG21 HD22 ' A' ' 118' ' ' LEU . 0.5 OUTLIER -87.74 115.27 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 104.72 -2.326 . . . . 0.0 104.72 168.729 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.73 153.33 29.77 Favored Glycine 0 CA--C 1.527 0.784 0 N-CA-C 109.321 -1.511 . . . . 0.0 109.321 170.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -145.35 144.35 30.65 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 103.872 -2.64 . . . . 0.0 103.872 171.372 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.434 ' N ' HD23 ' A' ' 103' ' ' LEU . 11.3 m -142.32 142.47 32.51 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 169.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -145.1 136.3 24.96 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -170.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.85 -24.46 52.67 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.907 0.483 . . . . 0.0 111.889 -175.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -143.53 157.41 44.46 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.896 0.878 . . . . 0.0 110.081 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.31 -35.12 73.22 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.52 -32.4 60.48 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.904 -1.122 . . . . 0.0 111.033 177.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.8 m -62.02 -42.28 99.0 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 169.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 22.2 t60 -57.71 -49.04 77.87 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.134 0.974 . . . . 0.0 110.17 173.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.4 mm -56.41 -54.98 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 118.89 0.768 . . . . 0.0 109.604 179.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.71 -38.85 94.46 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-N 118.549 0.613 . . . . 0.0 111.582 -176.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.37 -49.86 57.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.674 1.189 . . . . 0.0 110.901 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.0 mm -55.83 -42.7 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.588 1.155 . . . . 0.0 109.145 176.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.7 mm-40 -69.54 -14.59 62.93 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 118.381 -0.818 . . . . 0.0 111.936 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.85 -42.34 16.51 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 170.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.724 HD22 HG21 ' A' ' 101' ' ' ILE . 96.4 mt -68.76 -29.3 67.66 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 121.78 -0.575 . . . . 0.0 111.708 -177.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.1 m -56.61 -22.49 34.33 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 170.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -77.24 -18.29 57.76 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.584 1.084 . . . . 0.0 111.519 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 42.9 mt -103.51 -61.26 1.44 Allowed 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.971 0.908 . . . . 0.0 110.103 -177.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.51 -27.65 69.29 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.92 0.888 . . . . 0.0 113.046 -174.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.5 m -106.93 29.32 7.16 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.134 0.574 . . . . 0.0 110.577 -175.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -130.59 104.88 7.47 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 123.909 0.884 . . . . 0.0 108.686 175.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -58.63 -25.55 62.8 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.08 -177.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.53 -48.22 73.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 121.273 0.559 . . . . 0.0 109.564 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.59 -42.2 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 123.885 0.874 . . . . 0.0 109.013 175.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 45.5 mt -60.86 -33.91 73.8 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 118.714 0.688 . . . . 0.0 111.758 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -69.34 -43.46 73.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 120.821 -1.175 . . . . 0.0 109.587 172.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -62.95 -33.29 75.04 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.864 0.756 . . . . 0.0 110.321 -177.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.46 HD22 HD22 ' A' ' 99' ' ' LEU . 3.8 pp -81.16 -42.0 21.53 Favored 'General case' 0 C--N 1.342 0.241 0 C-N-CA 123.451 0.7 . . . . 0.0 111.2 177.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 55.2 mt -64.48 -20.25 66.07 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.551 1.069 . . . . 0.0 111.743 176.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 59.9 p -108.79 16.33 22.86 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.983 1.313 . . . . 0.0 111.167 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.39 102.62 0.71 Allowed 'General case' 0 C--N 1.346 0.42 0 CA-C-N 119.254 0.934 . . . . 0.0 111.18 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.3 m -71.75 -17.0 62.22 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.496 0.718 . . . . 0.0 112.272 175.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.3 p -153.76 162.44 41.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.813 0.733 . . . . 0.0 111.184 -171.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -57.61 -37.24 72.92 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.418 1.087 . . . . 0.0 109.401 169.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -58.39 -44.16 88.81 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-O 118.618 -0.706 . . . . 0.0 110.916 176.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -60.04 -38.13 81.86 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 119.122 0.874 . . . . 0.0 112.121 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 38.3 mt -69.9 -44.77 69.02 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.706 0.685 . . . . 0.0 109.971 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -65.55 -26.58 67.94 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.087 -1.008 . . . . 0.0 112.569 175.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -66.15 -35.81 81.47 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 120.344 -1.472 . . . . 0.0 110.826 174.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.44 -39.34 84.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.729 0.811 . . . . 0.0 109.784 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . 0.523 HD11 HD22 ' A' ' 81' ' ' LEU . 33.7 mm -58.21 -51.51 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 173.026 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.9 m -65.57 -24.53 67.11 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.469 -169.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . 0.472 ' HG3' HH11 ' A' ' 146' ' ' ARG . 2.2 ttm-85 -60.19 -25.29 65.46 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.398 1.479 . . . . 0.0 113.825 173.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.973 -0.904 . . . . 0.0 111.065 -173.666 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 tpt . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.43 112.84 1.91 Allowed 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 169.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.56 -34.01 73.53 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 169.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.9 p -59.53 -5.74 0.91 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.921 1.688 . . . . 0.0 113.413 171.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -109.19 11.54 25.44 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.098 1.359 . . . . 0.0 113.341 174.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -130.96 -46.63 1.02 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.34 1.056 . . . . 0.0 109.6 169.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -75.22 118.26 69.27 Favored Pre-proline 0 CA--C 1.542 0.642 0 N-CA-C 104.302 -2.481 . . . . 0.0 104.302 170.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.9 -78.71 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.646 2.231 . . . . 0.0 111.394 -169.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -168.5 165.39 12.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 128.316 2.646 . . . . 0.0 104.88 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 56.99 15.74 2.49 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.711 1.204 . . . . 0.0 113.719 171.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.5 m -117.53 28.64 8.33 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.95 1.3 . . . . 0.0 110.489 -169.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 mt -122.73 144.54 31.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 171.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 69.9 m -157.07 157.33 34.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.852 0.861 . . . . 0.0 109.488 169.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 99.2 t -122.21 141.06 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 104.248 -2.501 . . . . 0.0 104.248 170.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.5 mt -136.18 144.11 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 125.29 1.436 . . . . 0.0 107.86 -168.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -70.68 -36.04 73.11 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.159 -0.338 . . . . 0.0 111.24 177.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 p -175.11 146.41 0.85 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 126.299 1.84 . . . . 0.0 106.292 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.28 157.67 20.52 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 169.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -62.7 -37.11 85.18 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.009 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -165.2 -179.46 5.64 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 126.754 2.021 . . . . 0.0 107.125 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 69.0 p-90 -61.78 -35.17 77.37 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.882 0.765 . . . . 0.0 111.864 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.489 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 51.3 mt-30 -51.79 -53.94 34.32 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.64 1.176 . . . . 0.0 108.191 170.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -66.57 -34.39 77.78 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 121.684 -0.635 . . . . 0.0 111.185 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.24 -31.56 72.46 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 121.82 -0.55 . . . . 0.0 110.795 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.74 -48.3 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 170.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -56.51 -46.21 80.66 Favored 'General case' 0 C--O 1.223 -0.327 0 O-C-N 122.033 -0.417 . . . . 0.0 110.08 178.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -64.52 -29.32 70.35 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 118.003 -0.998 . . . . 0.0 112.293 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.2 m -66.93 -23.53 65.98 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 120.17 1.35 . . . . 0.0 111.869 172.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.1 mmt -123.79 -17.96 6.19 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 -168.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.8 p -57.17 -34.82 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 120.276 1.398 . . . . 0.0 112.472 -169.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.5 m -64.77 -44.65 89.34 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 118.654 0.661 . . . . 0.0 109.727 178.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 89.3 mt -65.05 -36.67 85.1 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.182 0.593 . . . . 0.0 109.709 177.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 51.1 tp -61.61 -48.25 81.76 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.22 0.608 . . . . 0.0 109.924 177.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -65.42 -37.14 86.04 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 124.157 0.983 . . . . 0.0 112.168 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -76.56 2.11 14.84 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.604 1.162 . . . . 0.0 111.859 175.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.414 0.0 OUTLIER 48.64 30.34 2.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.703 2.401 . . . . 0.0 116.019 -169.956 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -66.68 -23.66 66.16 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.11 -0.994 . . . . 0.0 109.762 168.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.0 pt -140.88 179.28 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 C-N-CA 126.063 1.745 . . . . 0.0 109.905 -177.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 m -121.09 160.53 23.47 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.899 2.08 . . . . 0.0 108.46 175.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.02 -33.23 71.72 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.318 -0.864 . . . . 0.0 112.883 -171.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -59.51 -30.82 68.84 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.864 -0.522 . . . . 0.0 111.885 176.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -61.16 -42.7 99.02 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.312 0.645 . . . . 0.0 110.574 -177.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.4 -50.38 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 174.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -68.78 -25.89 64.93 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.501 -0.762 . . . . 0.0 112.003 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.76 98.22 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 119.473 1.033 . . . . 0.0 110.909 174.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.9 mt -66.96 -44.06 88.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.489 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.6 mttt -60.9 -44.64 96.86 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.352 0.523 . . . . 0.0 109.915 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.69 -37.28 86.75 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.125 0.97 . . . . 0.0 111.47 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.0 m -63.31 -38.02 89.54 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.635 -0.666 . . . . 0.0 110.44 172.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 17.5 m . . . . . 0 CA--C 1.541 0.624 0 C-N-CA 123.434 0.694 . . . . 0.0 110.738 176.615 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.1 mm -135.2 142.42 39.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 126.6 1.96 . . . . 0.0 105.914 -174.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mp -132.16 -28.6 1.7 Allowed 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.38 0.672 . . . . 0.0 112.124 -173.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.13 164.87 20.2 Favored Pre-proline 0 C--O 1.238 0.47 0 C-N-CA 125.11 1.364 . . . . 0.0 107.596 173.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.13 123.45 11.0 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.28 1.987 . . . . 0.0 109.507 169.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.54 3.66 90.43 Favored Glycine 0 CA--C 1.535 1.338 0 CA-C-O 117.892 -1.504 . . . . 0.0 115.204 178.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 58.0 t -128.27 122.76 58.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 120.241 2.021 . . . . 0.0 108.56 -173.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.78 163.05 23.71 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 124.948 1.299 . . . . 0.0 110.262 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.2 ttm -132.8 60.46 50.11 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 123.414 0.686 . . . . 0.0 111.64 175.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -50.59 143.62 27.79 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.304 2.003 . . . . 0.0 114.432 -171.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -179.72 154.9 0.62 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 128.205 2.602 . . . . 0.0 106.672 -169.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.07 161.66 36.17 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 125.515 1.526 . . . . 0.0 107.631 169.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.6 ptt85 -49.93 139.56 17.08 Favored Pre-proline 0 CA--C 1.54 0.568 0 CA-C-O 118.079 -0.962 . . . . 0.0 109.729 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -46.89 -43.26 24.38 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 123.692 2.928 . . . . 0.0 113.008 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.08 -9.65 11.33 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.484 1.514 . . . . 0.0 114.368 -177.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 64.0 m -76.47 -3.91 39.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.011 0.823 . . . . 0.0 112.388 172.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 132.66 13.29 1.65 Allowed Glycine 0 C--N 1.334 0.456 0 CA-C-O 118.305 -1.275 . . . . 0.0 113.373 171.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.4 145.17 56.16 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.296 1.548 . . . . 0.0 109.231 169.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.0 mt -126.2 -33.92 2.58 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 124.444 1.098 . . . . 0.0 110.261 -175.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -139.52 168.59 19.48 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.103 1.761 . . . . 0.0 107.873 176.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 96.9 m -98.8 118.53 35.75 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 123.351 0.66 . . . . 0.0 109.247 177.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -165.63 177.82 40.7 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 123.804 0.716 . . . . 0.0 112.382 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.721 ' SD ' HD21 ' A' ' 118' ' ' LEU . 59.0 mtt -142.22 166.97 23.24 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.737 1.269 . . . . 0.0 112.841 -171.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.2 p -145.58 158.55 43.83 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.264 1.826 . . . . 0.0 108.762 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 mp -134.44 133.16 40.18 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.988 1.315 . . . . 0.0 107.542 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 26.6 m -139.05 134.9 33.6 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -174.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.1 tp -123.56 142.18 51.28 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 169.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.9 mp -121.34 115.98 23.95 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 126.973 2.109 . . . . 0.0 105.584 177.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -62.99 -25.03 68.19 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.115 0.966 . . . . 0.0 112.486 -174.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -110.52 -7.98 14.68 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.8 1.24 . . . . 0.0 111.765 177.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 59.39 -176.37 2.94 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 123.842 0.734 . . . . 0.0 112.065 -169.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -151.49 157.92 5.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 169.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -98.26 109.77 22.47 Favored 'General case' 0 C--N 1.333 -0.133 0 O-C-N 121.182 -0.949 . . . . 0.0 112.139 -169.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 . . . . . 0 N--CA 1.449 -0.523 0 N-CA-C 106.241 -1.762 . . . . 0.0 106.241 169.123 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 N--CA 1.46 -0.485 0 N-CA-C 111.612 -0.188 . . . . 0.0 111.612 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 28.4 mm -69.11 119.25 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.1 mtpt -97.14 -17.35 19.97 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.851 -1.071 . . . . 0.0 110.78 174.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.434 HD21 HD13 ' A' ' 131' ' ' LEU . 59.5 tp -142.09 128.44 19.98 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 119.951 1.251 . . . . 0.0 110.412 -169.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.1 mp -137.82 113.56 9.71 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -170.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.724 HG21 HD22 ' A' ' 118' ' ' LEU . 1.2 mp -100.16 111.56 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 175.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.7 147.79 31.33 Favored Glycine 0 CA--C 1.529 0.954 0 N-CA-C 110.065 -1.214 . . . . 0.0 110.065 173.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.34 141.05 37.66 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 171.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 28.5 p -131.33 142.34 50.07 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 127.58 2.352 . . . . 0.0 106.533 171.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -145.86 133.6 21.12 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.61 -22.17 57.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 122.818 0.447 . . . . 0.0 111.42 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -145.83 154.49 42.05 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.141 0.977 . . . . 0.0 109.77 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.04 -31.69 69.07 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -177.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -77.61 -32.85 53.77 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.24 0.927 . . . . 0.0 111.373 178.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 4.4 m -60.95 -42.88 99.1 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 169.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -48.83 77.01 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.539 1.136 . . . . 0.0 110.51 171.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 6.0 mm -58.24 -45.56 88.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 123.37 0.668 . . . . 0.0 110.57 -177.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -73.96 -33.64 57.09 Favored Glycine 0 CA--C 1.529 0.917 0 CA-C-N 119.715 1.143 . . . . 0.0 111.597 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.66 -46.96 80.23 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.122 0.969 . . . . 0.0 110.886 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -54.39 -45.04 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 125.076 1.35 . . . . 0.0 108.444 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -69.19 -9.96 55.43 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 118.297 -0.858 . . . . 0.0 112.807 -178.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -90.36 -38.43 13.34 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 119.796 1.18 . . . . 0.0 109.056 170.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.724 HD22 HG21 ' A' ' 101' ' ' ILE . 88.6 mt -72.76 -31.82 65.2 Favored 'General case' 0 CA--C 1.517 -0.321 0 O-C-N 121.759 -0.588 . . . . 0.0 111.055 -178.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.2 m -61.09 -20.91 63.17 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.495 0.718 . . . . 0.0 112.108 173.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -66.95 -25.19 66.22 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.656 1.116 . . . . 0.0 110.212 174.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 41.5 mt -103.04 -61.38 1.41 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.132 0.973 . . . . 0.0 111.046 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.98 -1.22 18.94 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -172.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 37.1 m -114.91 26.47 10.13 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.6 1.091 . . . . 0.0 111.653 173.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -138.58 96.73 3.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 -172.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -58.23 -23.91 57.47 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.677 0.791 . . . . 0.0 112.501 -173.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -62.73 -49.59 74.43 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 121.323 0.582 . . . . 0.0 109.624 174.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.82 -40.37 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 C-N-CA 124.646 1.178 . . . . 0.0 109.51 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 31.9 mt -54.79 -43.49 72.91 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 118.574 -0.727 . . . . 0.0 111.18 -172.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -67.17 -38.15 84.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 118.693 0.679 . . . . 0.0 110.708 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . 0.423 ' HB3' HD11 ' A' ' 143' ' ' ILE . 62.1 mt-30 -70.17 -32.64 70.69 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.038 0.535 . . . . 0.0 110.098 -176.004 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.434 HD13 HD21 ' A' ' 99' ' ' LEU . 30.2 mt -72.78 -52.5 14.75 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 169.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.2 mt -58.59 -11.62 3.22 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.512 1.125 . . . . 0.0 113.746 -175.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 62.5 p -116.12 15.67 16.02 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.101 1.361 . . . . 0.0 110.797 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.44 95.41 0.02 OUTLIER 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.02 1.328 . . . . 0.0 110.73 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 50.7 m -82.39 -14.59 54.97 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.686 0.794 . . . . 0.0 111.099 -176.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.2 m -146.76 154.98 42.03 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 125.929 1.692 . . . . 0.0 106.728 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -54.88 -35.1 63.73 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.042 1.337 . . . . 0.0 111.687 178.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -53.22 -36.23 60.8 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.18 0.592 . . . . 0.0 111.988 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -64.79 -35.85 82.41 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 123.999 0.919 . . . . 0.0 112.426 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 59.3 mt -67.83 -44.12 77.95 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -75.08 -24.13 58.13 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -176.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -60.22 -44.45 95.16 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 120.736 -1.228 . . . . 0.0 109.658 171.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.423 HD11 ' HB3' ' A' ' 130' ' ' GLN . 96.6 mt -68.87 -35.53 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 C-N-CA 124.581 1.153 . . . . 0.0 109.792 -178.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.9 -49.78 72.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 122.958 0.503 . . . . 0.0 110.315 169.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 39.3 m -64.79 -27.19 68.72 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -168.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 18.3 mtt180 -69.56 -25.85 64.2 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.201 0.6 . . . . 0.0 111.596 175.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.865 0 C-N-CA 125.815 1.674 . . . . 0.0 111.449 -169.583 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 tpt . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 110.202 -0.295 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -66.1 109.28 2.54 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 168.782 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -54.02 -45.19 71.49 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.35 -19.22 5.08 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.913 1.685 . . . . 0.0 113.712 -178.032 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -66.64 -30.7 71.03 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-N 119.494 1.043 . . . . 0.0 111.967 176.621 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -86.56 -34.46 19.92 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.902 -0.571 . . . . 0.0 112.042 -174.137 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -90.08 104.47 8.7 Favored Pre-proline 0 N--CA 1.471 0.608 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 -173.491 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.05 -66.11 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 122.935 2.423 . . . . 0.0 113.863 -169.368 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -167.49 -64.73 0.03 OUTLIER 'General case' 0 C--O 1.231 0.127 0 C-N-CA 125.49 1.516 . . . . 0.0 109.792 178.817 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -69.18 5.76 1.15 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.156 1.382 . . . . 0.0 112.26 177.159 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.44 -29.84 71.06 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 126.116 1.767 . . . . 0.0 111.216 -174.019 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.1 mm -91.23 134.96 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.323 0 C-N-CA 125.734 1.613 . . . . 0.0 107.109 -169.781 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.4 m -157.27 151.52 24.94 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.238 0.926 . . . . 0.0 111.223 170.717 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 76.5 t -122.62 143.55 35.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 169.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.8 mt -140.89 147.8 22.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -170.023 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -73.55 -47.14 43.04 Favored 'General case' 0 CA--C 1.531 0.218 0 O-C-N 121.701 -0.624 . . . . 0.0 109.935 172.055 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.9 p -161.85 146.28 12.76 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -177.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.93 158.81 29.2 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 169.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.97 -43.63 86.58 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.525 0.73 . . . . 0.0 109.956 174.787 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -167.78 178.03 5.46 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 128.377 2.671 . . . . 0.0 107.452 175.067 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -57.5 -35.6 70.44 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 126.021 1.729 . . . . 0.0 113.734 176.767 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.426 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.4 mt-30 -62.32 -51.18 68.68 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 120.52 1.509 . . . . 0.0 108.308 171.772 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -59.83 -34.26 72.86 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 121.76 -0.587 . . . . 0.0 111.501 179.176 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.87 -32.67 74.49 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.584 -0.698 . . . . 0.0 110.919 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.59 -45.82 81.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 172.113 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -56.72 -42.8 79.83 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 121.624 -0.673 . . . . 0.0 110.569 176.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -70.31 -16.37 63.0 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.222 -0.924 . . . . 0.0 112.996 174.209 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m -79.49 -19.11 50.51 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 120.088 1.313 . . . . 0.0 110.916 169.25 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 7.9 mmt -126.36 -17.42 5.16 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 -168.615 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -59.67 -36.15 63.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 120.908 1.685 . . . . 0.0 112.03 -169.37 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.0 m -61.83 -26.81 68.35 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.839 0.745 . . . . 0.0 112.074 179.42 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.8 mt -86.25 -43.83 12.63 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.96 1.304 . . . . 0.0 108.62 177.012 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.7 tp -55.89 -41.93 75.19 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.79 0.836 . . . . 0.0 110.779 177.638 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -60.16 -30.2 69.17 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 126.199 1.8 . . . . 0.0 113.556 -174.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.9 mttm -111.54 20.05 17.55 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -177.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.341 0.7 OUTLIER 47.47 35.99 4.69 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.403 1.881 . . . . 0.0 114.911 -176.022 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.408 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 49.6 m-85 -64.51 -22.18 66.89 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.258 -0.901 . . . . 0.0 110.112 168.574 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.7 pt -146.12 165.7 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 127.303 2.241 . . . . 0.0 107.569 -177.122 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.4 p -98.5 166.86 11.16 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.3 1.04 . . . . 0.0 108.864 169.292 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -60.72 -31.38 70.67 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.283 -0.886 . . . . 0.0 111.726 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -59.46 -32.86 70.62 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 122.935 0.494 . . . . 0.0 111.626 176.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -59.37 -45.97 89.95 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.964 0.505 . . . . 0.0 110.329 -179.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.406 ' H ' HD12 ' A' ' 43' ' ' ILE . 4.3 mp -60.01 -49.79 82.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 176.559 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -68.53 -27.24 65.92 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 118.27 -0.872 . . . . 0.0 112.082 -173.636 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.71 -45.0 90.53 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 119.417 1.008 . . . . 0.0 110.557 172.697 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 25.4 mt -68.52 -46.72 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 -178.493 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.7 mttt -59.73 -47.69 84.64 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -177.432 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.13 -44.08 97.43 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 123.85 0.86 . . . . 0.0 110.846 -177.176 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 m -59.74 -48.71 80.59 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.463 0.705 . . . . 0.0 109.942 175.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 69.4 m . . . . . 0 CA--C 1.536 0.404 0 C-N-CA 124.141 0.976 . . . . 0.0 111.27 178.912 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.8 mm -120.97 135.24 61.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 175.552 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.73 -31.44 4.25 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 122.965 0.506 . . . . 0.0 111.854 -169.517 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.82 164.01 18.46 Favored Pre-proline 0 C--O 1.236 0.368 0 C-N-CA 125.261 1.424 . . . . 0.0 107.532 -177.64 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -45.9 115.2 0.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.306 2.671 . . . . 0.0 111.853 171.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.55 1.07 87.88 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-O 117.719 -1.601 . . . . 0.0 114.693 176.199 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 69.9 t -124.93 122.13 62.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 119.966 1.883 . . . . 0.0 108.572 -169.925 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.12 169.76 11.38 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.372 1.469 . . . . 0.0 109.643 176.373 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.59 ' HE2' HD12 ' A' ' 122' ' ' LEU . 4.8 ttm -139.95 59.92 14.26 Favored Pre-proline 0 CA--C 1.537 0.445 0 C-N-CA 123.761 0.824 . . . . 0.0 110.698 174.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -57.24 123.85 14.79 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 121.232 1.288 . . . . 0.0 109.83 -174.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -167.08 172.46 10.05 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.129 2.572 . . . . 0.0 108.454 174.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -132.94 171.09 14.42 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.079 1.352 . . . . 0.0 110.24 -174.27 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -57.03 155.36 16.17 Favored Pre-proline 0 N--CA 1.472 0.632 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.602 173.082 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -61.26 -35.67 83.63 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 121.57 1.513 . . . . 0.0 109.361 -176.784 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -67.65 -12.72 61.09 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.971 1.309 . . . . 0.0 112.437 -176.338 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 71.0 m -79.96 -3.3 47.68 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.755 0.707 . . . . 0.0 111.669 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 130.55 19.99 1.28 Allowed Glycine 0 C--N 1.337 0.626 0 CA-C-O 118.33 -1.261 . . . . 0.0 113.343 175.324 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.09 146.12 52.85 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 119.792 1.796 . . . . 0.0 109.041 169.882 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.1 mt -133.71 -28.93 1.37 Allowed 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.776 1.23 . . . . 0.0 111.045 -173.659 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.408 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 87.5 mttt -139.91 174.0 10.95 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.226 1.81 . . . . 0.0 107.749 172.904 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 95.1 m -105.92 126.44 52.18 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.353 1.061 . . . . 0.0 110.613 176.128 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.99 -176.14 41.33 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 125.865 1.698 . . . . 0.0 111.661 -177.597 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 42.1 mtt -146.66 171.3 15.32 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.762 1.625 . . . . 0.0 111.902 -176.77 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.6 m -136.4 161.72 35.05 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.56 1.944 . . . . 0.0 108.469 174.546 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.484 HD22 HD11 ' A' ' 144' ' ' ILE . 30.5 tp -142.52 103.18 4.2 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.21 1.404 . . . . 0.0 108.137 178.508 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 89.7 m -121.76 138.53 54.33 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.97 0.908 . . . . 0.0 108.732 -171.577 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.422 HD23 ' N ' ' A' ' 84' ' ' LEU . 5.1 tt -134.33 133.28 40.51 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 124.214 1.005 . . . . 0.0 108.412 179.095 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.422 ' N ' HD23 ' A' ' 83' ' ' LEU . 8.7 mp -113.51 122.14 46.37 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 126.16 1.784 . . . . 0.0 107.122 179.554 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -60.56 -40.97 93.58 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 118.931 0.787 . . . . 0.0 111.738 -178.727 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -87.54 -20.95 25.75 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 124.371 1.068 . . . . 0.0 111.414 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.5 -177.61 21.0 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 110.591 -1.003 . . . . 0.0 110.591 -168.708 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -148.56 167.54 3.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 169.241 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -120.03 95.99 4.98 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 121.756 -0.59 . . . . 0.0 110.205 -169.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 . . . . . 0 CA--C 1.539 0.527 0 C-N-CA 123.163 0.585 . . . . 0.0 110.392 170.834 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo . . . . . 0 N--CA 1.459 -0.557 0 CA-C-O 121.381 0.492 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 36.3 mm -112.99 139.27 39.02 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.357 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -178.266 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -116.94 -7.73 11.36 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 117.835 -1.079 . . . . 0.0 110.743 175.644 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' LEU . . . . . 0.446 HD21 HD13 ' A' ' 131' ' ' LEU . 15.4 tp -145.1 134.08 22.55 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 120.161 1.346 . . . . 0.0 110.712 -176.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mp -138.52 111.6 7.9 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 -169.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.8 mp -92.84 114.79 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 172.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.16 154.02 47.37 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 170.002 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.521 HD23 ' N ' ' A' ' 104' ' ' SER . 0.8 OUTLIER -143.77 150.4 38.51 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 169.741 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.521 ' N ' HD23 ' A' ' 103' ' ' LEU . 27.0 p -144.5 142.29 30.14 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 168.815 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . 0.578 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -150.59 132.75 15.35 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 119.395 0.998 . . . . 0.0 108.505 -179.653 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.28 -19.85 57.9 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.818 -174.176 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -140.48 154.59 46.65 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.888 0.875 . . . . 0.0 110.352 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.82 -37.46 76.45 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -178.161 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -71.85 -30.22 65.22 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.966 -1.083 . . . . 0.0 110.83 176.43 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.3 m -65.87 -36.42 83.38 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.437 169.835 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' HIS . . . . . 0.578 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 49.9 m-70 -59.82 -48.87 79.94 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 119.858 1.208 . . . . 0.0 109.476 170.857 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.3 mm -55.34 -54.65 22.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-N 118.703 0.683 . . . . 0.0 109.35 179.518 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.29 -39.25 96.95 Favored Glycine 0 CA--C 1.53 0.997 0 CA-C-N 118.888 0.767 . . . . 0.0 111.692 -176.183 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.428 ' CB ' HD21 ' A' ' 103' ' ' LEU . . . -65.67 -54.97 20.28 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.912 0.885 . . . . 0.0 110.373 179.007 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.6 mm -51.6 -48.24 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 C-N-CA 125.901 1.68 . . . . 0.0 108.424 177.037 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -66.79 -18.01 65.16 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.503 -0.748 . . . . 0.0 111.876 -176.524 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.86 -48.4 8.79 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 123.691 0.796 . . . . 0.0 109.369 173.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.426 HD21 HD12 ' A' ' 103' ' ' LEU . 3.2 pp -67.57 -23.56 65.42 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 118.24 0.473 . . . . 0.0 112.131 -178.986 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . 0.426 ' N ' HD12 ' A' ' 118' ' ' LEU . 60.2 m -62.95 -22.91 67.13 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.863 0.865 . . . . 0.0 111.726 174.056 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -66.17 -17.46 64.74 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.945 0.793 . . . . 0.0 110.035 173.505 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 34.8 mt -108.62 -60.94 1.67 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.009 1.324 . . . . 0.0 110.119 179.456 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.59 HD12 ' HE2' ' A' ' 65' ' ' MET . 9.9 mt -62.77 -21.03 65.55 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.877 1.436 . . . . 0.0 114.877 -175.604 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 38.1 m -111.13 26.15 11.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.945 0.793 . . . . 0.0 110.826 -179.201 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -132.51 97.38 4.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.064 1.346 . . . . 0.0 107.74 178.409 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.06 -27.8 54.92 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.691 0.797 . . . . 0.0 112.456 -177.128 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -65.12 -44.55 88.34 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 123.163 0.585 . . . . 0.0 110.02 176.584 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.92 -43.31 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 174.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.474 HD21 ' HA ' ' A' ' 122' ' ' LEU . 55.8 mt -55.66 -43.5 76.35 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 118.58 0.627 . . . . 0.0 111.128 -174.532 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -67.37 -38.85 85.41 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.775 0.43 . . . . 0.0 110.614 178.797 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -70.03 -33.23 71.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 118.663 0.665 . . . . 0.0 109.91 -176.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 131' ' ' LEU . . . . . 0.446 HD13 HD21 ' A' ' 99' ' ' LEU . 32.4 mt -68.3 -56.31 9.05 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 169.834 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 40.3 mt -57.64 -12.12 2.63 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 -174.395 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 50.9 p -114.11 7.45 16.69 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.067 1.347 . . . . 0.0 111.433 179.358 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.48 110.86 1.2 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.499 1.519 . . . . 0.0 110.235 175.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.6 m -68.25 -28.02 66.85 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.099 0.559 . . . . 0.0 111.838 176.846 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.2 m -149.54 160.53 43.4 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.056 1.343 . . . . 0.0 108.917 -172.183 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 57.2 mp0 -54.24 -34.47 60.79 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.119 1.367 . . . . 0.0 111.408 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -53.22 -38.27 62.77 Favored 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 123.119 0.568 . . . . 0.0 112.442 -179.893 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -80.75 -27.7 36.72 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 119.024 0.829 . . . . 0.0 110.605 -178.234 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.9 mt -65.48 -50.5 65.11 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.434 1.015 . . . . 0.0 108.303 171.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.72 -33.94 73.66 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.123 0.969 . . . . 0.0 112.679 176.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -59.83 -43.45 94.56 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 118.955 0.798 . . . . 0.0 110.677 175.185 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 77.4 mt -70.5 -35.12 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 123.166 0.586 . . . . 0.0 109.716 -178.57 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 144' ' ' ILE . . . . . 0.484 HD11 HD22 ' A' ' 81' ' ' LEU . 22.3 mm -57.17 -52.37 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 169.469 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 21.4 m -65.1 -27.83 69.03 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.279 -170.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -59.3 -24.55 63.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.275 1.83 . . . . 0.0 113.601 174.565 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.931 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 -176.966 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.484 1.249 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.2 mpt_? -58.71 121.09 10.2 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 169.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.79 -45.42 78.48 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 174.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.7 m -52.91 -28.03 21.45 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.29 1.436 . . . . 0.0 113.701 -175.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -58.15 -27.53 63.88 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.771 0.829 . . . . 0.0 112.343 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 99.3 m-85 -92.68 -7.26 47.3 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.886 0.875 . . . . 0.0 112.851 -177.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -108.7 106.01 57.99 Favored Pre-proline 0 CA--C 1.537 0.46 0 CA-C-N 119.967 1.258 . . . . 0.0 108.568 -171.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.87 -62.22 0.12 Allowed 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.598 2.199 . . . . 0.0 113.299 -173.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -174.33 -65.93 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.67 1.188 . . . . 0.0 109.182 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 3.1 m -73.26 2.97 6.37 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.229 1.411 . . . . 0.0 112.604 -176.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -69.19 -4.01 15.89 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 128.436 2.694 . . . . 0.0 114.289 -169.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 21.0 mt -126.55 127.12 70.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-N 120.332 1.423 . . . . 0.0 108.188 -168.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 50.9 m -143.36 145.92 33.09 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.292 1.037 . . . . 0.0 111.308 -171.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.9 t -123.85 135.69 62.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 105.441 -2.059 . . . . 0.0 105.441 165.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 55.9 mt -138.7 143.06 33.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 N-CA-C 105.753 -1.943 . . . . 0.0 105.753 -168.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 44.4 t60 -68.18 -49.25 62.11 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.812 -0.555 . . . . 0.0 110.037 -178.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -160.07 145.11 14.98 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.628 1.571 . . . . 0.0 107.088 171.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -69.5 150.37 47.24 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 167.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -60.49 -40.64 92.05 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.578 0.351 . . . . 0.0 110.832 178.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -161.46 178.25 9.31 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.248 1.419 . . . . 0.0 108.886 178.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.6 -32.94 63.51 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.915 0.886 . . . . 0.0 113.057 178.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.6 mt-30 -76.83 -42.67 39.41 Favored 'General case' 0 C--N 1.339 0.13 0 CA-C-N 119.842 1.201 . . . . 0.0 109.499 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -64.81 -29.06 70.0 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 117.976 0.353 . . . . 0.0 110.602 179.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.8 -40.73 98.25 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.373 -0.83 . . . . 0.0 111.313 173.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 1.7 mt -67.0 -43.52 89.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -59.14 -47.21 86.13 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.403 0.547 . . . . 0.0 111.081 -179.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -66.19 -20.89 66.27 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.069 0.85 . . . . 0.0 112.844 176.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.9 m -79.47 -8.24 58.99 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 119.223 0.919 . . . . 0.0 112.181 172.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 23.2 mmt -131.31 -24.74 2.27 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.9 0.88 . . . . 0.0 112.731 -166.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.9 p -58.99 -36.91 64.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 119.216 0.917 . . . . 0.0 111.383 -171.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -66.54 -24.48 66.38 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.61 -0.682 . . . . 0.0 112.819 178.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 58.2 mt -85.22 -41.23 15.8 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 123.871 0.869 . . . . 0.0 109.118 174.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.0 tp -58.81 -40.29 83.68 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.096 0.958 . . . . 0.0 110.61 175.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -62.5 -26.19 68.41 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.731 1.213 . . . . 0.0 112.935 -176.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -108.08 14.73 24.89 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.367 0.667 . . . . 0.0 110.738 176.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.254 10.8 p30 45.24 41.97 6.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.361 1.865 . . . . 0.0 113.698 -172.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -64.06 -22.29 66.87 Favored 'General case' 0 CA--C 1.539 0.519 0 O-C-N 120.973 -1.079 . . . . 0.0 110.766 159.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.6 pt -143.45 163.5 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 126.301 1.84 . . . . 0.0 109.011 -178.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.1 m -97.56 163.73 12.73 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.979 1.712 . . . . 0.0 109.274 166.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -57.51 -35.47 70.3 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.598 0.759 . . . . 0.0 112.318 -178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -58.9 -30.65 67.96 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 123.143 0.577 . . . . 0.0 112.206 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.74 -45.06 93.36 Favored 'General case' 0 N--CA 1.456 -0.135 0 C-N-CA 123.166 0.587 . . . . 0.0 110.244 -179.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.457 ' H ' HD12 ' A' ' 43' ' ' ILE . 4.5 mp -64.1 -47.31 90.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -64.73 -31.02 72.06 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 118.62 -0.705 . . . . 0.0 111.567 -174.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.55 -42.24 96.18 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.211 0.914 . . . . 0.0 111.16 174.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 19.1 mt -67.11 -46.27 84.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -58.45 -49.31 77.77 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 118.248 0.476 . . . . 0.0 110.079 -179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -62.93 -41.65 99.55 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 123.234 0.614 . . . . 0.0 111.011 -177.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 28.0 m -64.68 -40.93 96.25 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.692 0.397 . . . . 0.0 111.228 176.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 89.5 m -61.67 -44.52 96.8 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 123.866 0.866 . . . . 0.0 109.784 178.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 76.6 mt -65.33 -42.13 93.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 C-N-CA 123.27 0.628 . . . . 0.0 109.647 177.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -69.94 -34.05 72.93 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 -174.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 25.5 t30 -140.62 -57.39 0.52 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.424 0.556 . . . . 0.0 111.123 -169.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 153.42 172.84 22.01 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 109.269 -1.533 . . . . 0.0 109.269 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -64.0 128.95 23.07 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 122.258 1.972 . . . . 0.0 109.817 177.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -64.95 -48.35 74.36 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 122.385 0.274 . . . . 0.0 110.897 -179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -112.48 88.63 2.87 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -160.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.5 mm -112.62 131.1 65.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 104.945 -2.242 . . . . 0.0 104.945 169.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -116.71 -27.17 6.74 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 122.784 0.434 . . . . 0.0 111.464 -168.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.05 161.39 29.58 Favored Pre-proline 0 CA--C 1.535 0.376 0 C-N-CA 125.53 1.532 . . . . 0.0 107.158 174.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -47.91 115.63 1.57 Allowed 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.11 2.54 . . . . 0.0 111.085 170.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.52 3.66 71.43 Favored Glycine 0 CA--C 1.531 1.087 0 CA-C-O 117.928 -1.484 . . . . 0.0 114.508 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.1 t -129.95 127.25 63.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 119.781 1.79 . . . . 0.0 109.563 -169.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.29 168.8 17.91 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.069 1.347 . . . . 0.0 110.915 -177.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 3.2 ttm -140.99 73.26 27.18 Favored Pre-proline 0 CA--C 1.542 0.663 0 C-N-CA 123.622 0.769 . . . . 0.0 110.947 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -50.38 122.68 9.85 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 122.991 2.46 . . . . 0.0 112.774 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 13.4 t-80 -163.39 155.06 17.28 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.176 1.791 . . . . 0.0 107.471 -175.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.61 165.86 25.82 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.329 1.452 . . . . 0.0 108.077 171.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -60.63 153.25 63.23 Favored Pre-proline 0 N--CA 1.469 0.523 0 O-C-N 121.272 -0.892 . . . . 0.0 109.876 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -46.9 -46.75 17.86 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.218 2.612 . . . . 0.0 113.048 176.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -66.99 -11.05 55.79 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.601 1.16 . . . . 0.0 113.867 -177.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 80.8 m -74.39 -11.59 60.29 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.646 1.112 . . . . 0.0 112.355 172.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 136.42 24.23 0.5 Allowed Glycine 0 CA--C 1.526 0.735 0 CA-C-O 118.71 -1.05 . . . . 0.0 113.86 171.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.32 155.39 38.24 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 119.547 1.674 . . . . 0.0 109.069 168.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.8 mt -132.86 -25.78 1.82 Allowed 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.796 1.239 . . . . 0.0 111.063 -174.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.6 mttt -145.88 -168.72 3.06 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 126.652 1.981 . . . . 0.0 106.85 178.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 41.0 m -125.45 126.79 45.48 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.363 0.665 . . . . 0.0 109.582 -177.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.37 -176.23 40.98 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.046 0.831 . . . . 0.0 111.73 -176.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 62.1 mtt -143.71 168.47 19.82 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.562 1.545 . . . . 0.0 111.401 -176.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 11.3 m -138.21 168.7 19.18 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.385 1.874 . . . . 0.0 108.478 171.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 8.4 tp -151.45 120.84 6.84 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.95 1.7 . . . . 0.0 107.425 178.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 42.4 m -136.17 129.02 31.07 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 -171.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.8 tp -117.56 136.67 53.11 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 175.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.3 mp -115.48 116.15 27.72 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -59.41 -39.88 84.87 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.637 0.653 . . . . 0.0 111.621 -175.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -102.36 -2.31 29.16 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.38 0.672 . . . . 0.0 112.309 179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 65.85 -175.05 18.5 Favored Glycine 0 CA--C 1.532 1.107 0 C-N-CA 124.198 0.904 . . . . 0.0 113.674 -176.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -150.59 149.03 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 167.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -86.67 119.27 26.73 Favored 'General case' 0 CA--C 1.529 0.154 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -85.91 144.31 39.06 Favored Pre-proline 0 CA--C 1.535 0.395 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 172.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -66.07 137.0 46.69 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 122.035 1.823 . . . . 0.0 109.936 -174.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 74.8 -7.51 20.16 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-O 118.232 -1.316 . . . . 0.0 114.219 177.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -76.3 162.36 27.98 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.933 1.867 . . . . 0.0 109.884 172.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -77.71 -26.5 50.13 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -175.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -156.47 169.25 10.84 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 124.552 1.141 . . . . 0.0 109.823 -175.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -71.27 146.8 51.94 Favored 'Trans proline' 0 N--CA 1.457 -0.646 0 CA-C-N 121.108 1.431 . . . . 0.0 111.783 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 48.4 mm -88.39 135.73 24.94 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 106.922 -1.51 . . . . 0.0 106.922 177.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 33.1 mtpt -109.86 -25.04 10.53 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.742 0.817 . . . . 0.0 111.487 172.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 55.4 tp -127.98 126.51 41.51 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -169.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 mp -133.28 139.27 46.82 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 -178.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.472 HD12 HD21 ' A' ' 122' ' ' LEU . 4.7 mt -125.49 123.62 65.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 173.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.99 155.48 36.75 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 176.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -149.99 138.73 20.85 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 176.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 54.3 p -139.11 155.45 47.88 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.107 1.363 . . . . 0.0 108.815 164.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.57 140.79 22.22 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.485 0.714 . . . . 0.0 109.634 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.23 -16.99 59.71 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.489 0.551 . . . . 0.0 112.489 179.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -154.4 154.81 33.89 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.645 1.178 . . . . 0.0 109.221 -173.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.46 -35.36 73.92 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.62 0.768 . . . . 0.0 112.79 -178.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -70.52 -38.55 74.28 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 119.474 1.034 . . . . 0.0 110.429 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.1 m -63.55 -38.23 90.36 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.172 0.589 . . . . 0.0 110.31 173.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -59.45 -49.23 78.62 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.096 172.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.4 mm -58.97 -46.08 91.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 119.557 1.072 . . . . 0.0 109.876 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.06 -46.64 93.45 Favored Glycine 0 CA--C 1.53 1.004 0 CA-C-N 118.846 0.748 . . . . 0.0 111.342 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -62.08 -46.36 89.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.419 0.688 . . . . 0.0 111.232 178.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.3 mm -56.62 -51.95 59.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.162 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 176.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 95.4 mm-40 -59.14 -33.87 71.39 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 118.782 -0.628 . . . . 0.0 111.419 -178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -64.92 -56.31 14.08 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.764 0.711 . . . . 0.0 110.489 173.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . 0.275 1.4 pp -71.3 -17.41 62.46 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 -174.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.5 m -60.07 -27.28 66.84 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 120.155 1.343 . . . . 0.0 111.607 170.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -65.08 -12.29 49.08 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 119.026 0.83 . . . . 0.0 111.801 175.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 69.6 mt -111.78 -51.52 2.85 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.397 1.079 . . . . 0.0 109.428 177.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.472 HD21 HD12 ' A' ' 101' ' ' ILE . 13.6 mt -73.45 -19.95 60.83 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -170.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.4 m -108.95 21.02 17.76 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.92 0.888 . . . . 0.0 110.758 -177.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -128.04 100.04 5.72 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -57.44 -28.62 63.49 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.687 0.795 . . . . 0.0 112.599 -175.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.31 -39.17 93.37 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.137 0.575 . . . . 0.0 110.386 176.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.71 -40.29 47.07 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 176.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.1 mt -57.7 -43.94 85.54 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 118.997 0.817 . . . . 0.0 110.615 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -57.83 -51.45 69.54 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.457 0.571 . . . . 0.0 110.05 175.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -65.05 -33.35 75.83 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.732 0.413 . . . . 0.0 112.087 -175.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 63.3 mt -68.06 -47.37 68.51 Favored 'General case' 0 CA--C 1.529 0.14 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 173.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.0 mt -64.22 -34.87 79.08 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-O 118.891 -0.576 . . . . 0.0 111.743 -176.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 63.8 p -87.49 -0.66 57.15 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.088 0.858 . . . . 0.0 112.343 179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.42 118.19 5.3 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-N 119.368 0.985 . . . . 0.0 111.23 -171.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.6 m -73.05 -20.17 61.03 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.174 0.59 . . . . 0.0 112.272 -177.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.5 p -155.68 164.65 38.32 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.592 0.71 . . . . 0.0 110.832 -170.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 93.0 mt-10 -58.09 -30.94 66.64 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.786 0.834 . . . . 0.0 110.528 170.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.0 tptt -64.61 -44.01 91.94 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.47 0.577 . . . . 0.0 110.53 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 -67.55 -37.95 83.43 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.258 0.481 . . . . 0.0 110.225 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 56.0 mt -60.59 -45.85 92.43 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.331 0.514 . . . . 0.0 110.357 173.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.13 -38.81 92.63 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.562 0.745 . . . . 0.0 111.637 -179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -56.52 -42.45 78.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 118.759 0.709 . . . . 0.0 110.995 177.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 70.9 mt -66.78 -35.02 73.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 122.98 0.512 . . . . 0.0 109.782 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 26.4 mm -64.68 -49.55 79.77 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 119.143 0.883 . . . . 0.0 109.316 172.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 38.4 m -59.03 -30.54 68.1 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.102 0.865 . . . . 0.0 112.392 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.6 ttm180 -65.93 -22.1 66.47 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.272 1.029 . . . . 0.0 112.415 178.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.945 0 N-CA-C 109.001 -1.64 . . . . 0.0 109.001 -178.845 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 tpt . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 120.738 0.304 . . . . 0.0 110.946 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -68.99 109.48 3.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 169.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.18 -44.29 83.43 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 124.351 1.06 . . . . 0.0 109.81 -172.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -55.07 -23.43 20.22 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.723 1.209 . . . . 0.0 112.682 -175.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -58.94 -28.41 66.23 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.776 0.716 . . . . 0.0 111.981 176.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -92.48 -13.29 30.13 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 117.911 -1.043 . . . . 0.0 112.66 -176.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -112.67 85.33 7.36 Favored Pre-proline 0 CA--C 1.54 0.563 0 CA-C-N 120.974 1.715 . . . . 0.0 107.215 -173.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.58 -59.52 1.16 Allowed 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 123.724 2.949 . . . . 0.0 115.464 -169.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.483 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.8 tp10 -161.62 -77.02 0.05 Allowed 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 118.677 0.672 . . . . 0.0 112.271 -178.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -68.61 13.62 0.09 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.109 1.764 . . . . 0.0 111.843 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 9' ' ' GLU . 5.5 m -75.65 8.7 2.75 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 128.508 2.723 . . . . 0.0 113.452 -168.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 9.4 mm -135.82 134.73 51.14 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 N-CA-C 104.491 -2.411 . . . . 0.0 104.491 -169.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 75.7 m -155.33 147.31 23.48 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 118.83 0.741 . . . . 0.0 110.454 174.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 77.4 t -124.06 136.19 61.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 103.866 -2.642 . . . . 0.0 103.866 169.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 37.6 mt -139.0 147.86 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 N-CA-C 105.159 -2.163 . . . . 0.0 105.159 -169.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -66.87 -42.69 85.19 Favored 'General case' 0 CA--C 1.535 0.398 0 O-C-N 121.389 -0.819 . . . . 0.0 110.714 175.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -167.4 145.7 4.81 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -176.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.41 155.19 36.63 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 169.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.2 tppt? -60.26 -40.12 89.21 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 176.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -167.84 -177.06 3.29 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 128.019 2.528 . . . . 0.0 107.521 172.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -61.76 -33.78 74.69 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 177.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.484 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.7 mt-30 -59.75 -51.48 69.58 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.621 1.555 . . . . 0.0 107.433 172.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -60.57 -34.55 74.35 Favored 'General case' 0 C--O 1.223 -0.337 0 O-C-N 121.646 -0.659 . . . . 0.0 111.521 177.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.15 -32.5 73.99 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.629 -0.67 . . . . 0.0 110.883 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.94 -47.47 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 171.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -56.68 -45.45 81.74 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.743 -0.598 . . . . 0.0 110.557 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.2 m-85 -68.57 -17.46 64.14 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 118.048 -0.977 . . . . 0.0 112.64 174.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 46.9 m -80.25 -17.61 51.74 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 120.866 1.666 . . . . 0.0 111.87 169.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.8 mmt -125.0 -18.44 5.49 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -169.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.3 p -59.4 -36.23 62.98 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-N 120.437 1.471 . . . . 0.0 111.734 -169.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.8 m -63.15 -22.34 66.8 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.757 0.708 . . . . 0.0 112.269 179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 80.7 mt -89.91 -41.68 11.65 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.24 1.016 . . . . 0.0 109.125 174.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -55.36 -42.15 73.52 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.61 0.764 . . . . 0.0 110.576 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -66.75 -24.26 66.19 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 125.816 1.646 . . . . 0.0 114.102 -171.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -111.01 21.96 15.84 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 118.029 0.377 . . . . 0.0 110.422 172.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 54.84 34.19 21.46 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.996 1.318 . . . . 0.0 113.166 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 49.3 m-85 -68.37 -22.12 64.68 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 120.583 -1.323 . . . . 0.0 109.71 168.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.1 pt -142.2 174.69 5.69 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 126.74 2.016 . . . . 0.0 108.557 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.4 m -112.24 159.9 18.15 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 126.471 1.908 . . . . 0.0 107.813 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -60.2 -31.22 69.95 Favored 'General case' 0 N--CA 1.47 0.547 0 O-C-N 121.24 -0.913 . . . . 0.0 112.337 -174.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.1 t30 -58.09 -32.48 68.11 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.052 0.541 . . . . 0.0 112.004 175.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -61.13 -44.13 97.81 Favored 'General case' 0 CA--C 1.529 0.157 0 C-N-CA 123.358 0.663 . . . . 0.0 110.48 -177.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.406 ' H ' HD12 ' A' ' 43' ' ' ILE . 4.2 mp -59.17 -50.13 80.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 174.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 36.9 tp60 -69.37 -25.01 63.96 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.437 -0.792 . . . . 0.0 112.142 -175.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.51 -42.56 98.99 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 119.699 1.136 . . . . 0.0 110.627 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.0 mt -68.4 -45.53 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 178.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.484 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.3 mttt -60.73 -41.08 94.61 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 118.382 0.537 . . . . 0.0 110.096 -178.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -65.15 -38.76 91.62 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.892 0.877 . . . . 0.0 111.41 177.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -63.05 -36.7 84.44 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.652 -0.655 . . . . 0.0 110.376 172.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 24.6 m -67.47 -36.98 82.21 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.04 0.936 . . . . 0.0 110.664 176.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 86.9 mt -64.65 -42.34 94.79 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 119.171 0.896 . . . . 0.0 109.578 172.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -64.52 -34.4 78.15 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 123.468 0.707 . . . . 0.0 112.329 -172.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -150.25 -51.05 0.14 Allowed 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 123.229 0.612 . . . . 0.0 111.253 -169.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.28 -179.46 22.36 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 109.028 -1.629 . . . . 0.0 109.028 -173.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_exo -42.0 117.8 0.82 Allowed 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.845 3.03 . . . . 0.0 112.634 171.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -77.99 -14.0 59.68 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.626 176.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -136.55 103.0 5.1 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.517 1.127 . . . . 0.0 108.162 -169.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.2 mm -138.59 140.88 38.57 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mp -132.58 -27.91 1.68 Allowed 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -169.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.2 160.88 24.22 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.77 114.42 1.36 Allowed 'Trans proline' 0 N--CA 1.456 -0.694 0 C-N-CA 122.728 2.285 . . . . 0.0 111.15 174.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.39 12.5 72.85 Favored Glycine 0 CA--C 1.529 0.908 0 CA-C-O 118.137 -1.368 . . . . 0.0 114.19 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 24.2 t -129.86 127.15 63.59 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 CA-C-N 119.722 1.761 . . . . 0.0 108.827 -174.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.71 169.46 12.52 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.61 1.564 . . . . 0.0 109.809 179.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.418 ' CE ' HD13 ' A' ' 118' ' ' LEU . 14.5 ttm -143.51 67.98 16.69 Favored Pre-proline 0 CA--C 1.536 0.436 0 O-C-N 121.926 -0.484 . . . . 0.0 111.295 176.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -56.06 149.4 53.27 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 121.297 1.331 . . . . 0.0 113.066 -174.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 174.15 153.44 0.11 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 128.582 2.753 . . . . 0.0 106.28 -169.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.85 166.1 24.09 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 125.988 1.715 . . . . 0.0 106.903 172.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -52.71 147.86 14.36 Favored Pre-proline 0 CA--C 1.536 0.421 0 CA-C-O 118.526 -0.749 . . . . 0.0 109.352 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_exo -47.44 -42.13 28.65 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.794 2.33 . . . . 0.0 112.281 174.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -62.77 -13.8 37.37 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.491 1.116 . . . . 0.0 113.712 -177.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 71.6 m -78.28 -0.68 29.69 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.857 0.753 . . . . 0.0 111.827 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.54 15.03 2.26 Favored Glycine 0 C--N 1.336 0.53 0 CA-C-O 118.32 -1.267 . . . . 0.0 112.929 171.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.33 147.96 52.54 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 119.42 1.61 . . . . 0.0 109.549 169.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.1 mt -131.32 -33.5 1.48 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 124.519 1.128 . . . . 0.0 110.402 -174.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -145.5 156.69 43.87 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.516 1.527 . . . . 0.0 108.104 177.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.9 m -90.14 132.68 35.32 Favored 'General case' 0 N--CA 1.443 -0.782 0 C-N-CA 122.984 0.514 . . . . 0.0 110.365 -176.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.01 -176.17 43.08 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 124.739 1.161 . . . . 0.0 110.8 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 46.9 mtt -148.9 170.87 17.32 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.552 1.941 . . . . 0.0 110.284 -177.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.42 162.67 40.12 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.085 1.754 . . . . 0.0 108.339 179.027 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 13.1 tp -146.42 122.45 10.74 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 126.207 1.803 . . . . 0.0 108.338 -172.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 74.2 m -137.25 143.79 42.41 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.373 1.069 . . . . 0.0 108.522 -171.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.2 tt -141.81 131.65 24.35 Favored 'General case' 0 C--O 1.232 0.16 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 177.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -107.25 118.08 35.77 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 126.769 2.027 . . . . 0.0 107.018 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -59.49 -34.73 72.94 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 118.985 0.812 . . . . 0.0 112.45 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -96.67 -10.6 26.62 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.03 0.932 . . . . 0.0 112.097 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.73 179.97 11.88 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -169.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -149.23 161.38 5.03 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 106.697 -1.594 . . . . 0.0 106.697 169.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -109.02 118.02 35.72 Favored 'General case' 0 CA--C 1.519 -0.222 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -169.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -79.84 153.67 75.4 Favored Pre-proline 0 CA--C 1.541 0.603 0 C-N-CA 123.798 0.839 . . . . 0.0 109.65 174.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -78.94 -3.68 13.39 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 123.379 2.719 . . . . 0.0 115.417 -169.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -150.49 35.51 0.95 Allowed Glycine 0 C--N 1.339 0.695 0 CA-C-N 119.357 0.981 . . . . 0.0 112.532 -172.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -135.78 154.18 51.3 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 171.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -65.97 -30.5 71.07 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -169.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -139.05 161.76 56.12 Favored Pre-proline 0 CA--C 1.543 0.698 0 C-N-CA 123.696 0.798 . . . . 0.0 111.834 -172.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.87 143.32 32.99 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 122.629 2.219 . . . . 0.0 110.204 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 30.6 mm -85.9 135.43 25.01 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -110.04 -16.35 13.83 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 117.379 -1.296 . . . . 0.0 111.069 172.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 40.7 tp -147.79 135.04 20.53 Favored 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 120.409 1.459 . . . . 0.0 110.429 -169.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.7 mp -138.99 136.99 35.96 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.307 1.043 . . . . 0.0 109.061 -172.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 4.0 mt -116.72 115.42 48.94 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.051 0 N-CA-C 106.652 -1.61 . . . . 0.0 106.652 168.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -76.81 152.52 40.83 Favored Glycine 0 CA--C 1.527 0.84 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 171.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.494 HD23 ' N ' ' A' ' 104' ' ' SER . 0.5 OUTLIER -144.32 137.83 27.45 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 104.856 -2.276 . . . . 0.0 104.856 169.703 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.494 ' N ' HD23 ' A' ' 103' ' ' LEU . 92.1 p -129.99 148.03 51.8 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 126.047 1.739 . . . . 0.0 107.412 169.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.84 136.6 23.13 Favored 'General case' 0 CA--C 1.513 -0.474 0 O-C-N 121.625 -0.672 . . . . 0.0 109.671 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.22 -21.35 60.66 Favored 'General case' 0 N--CA 1.453 -0.32 0 O-C-N 123.525 0.515 . . . . 0.0 111.628 178.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -143.92 153.0 41.84 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 123.863 0.865 . . . . 0.0 109.738 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.43 -33.37 71.17 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -176.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -77.61 -31.04 52.64 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.306 0.957 . . . . 0.0 111.236 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.5 m -63.53 -37.99 89.42 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.901 -0.499 . . . . 0.0 109.701 169.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -47.7 84.37 Favored 'General case' 0 C--N 1.34 0.172 0 C-N-CA 124.191 0.996 . . . . 0.0 110.219 171.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.0 mm -58.38 -50.62 78.01 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.03 -39.2 93.99 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-N 119.115 0.871 . . . . 0.0 111.93 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.12 -52.66 32.31 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.567 1.147 . . . . 0.0 110.567 179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.0 mm -50.81 -47.34 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 C-N-CA 125.508 1.523 . . . . 0.0 108.671 173.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.5 mm-40 -66.55 -9.45 35.1 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 120.974 -1.079 . . . . 0.0 112.542 -178.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -93.87 -48.5 6.25 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 124.204 1.002 . . . . 0.0 109.626 169.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.548 HD12 ' N ' ' A' ' 119' ' ' SER . 1.1 pp -72.39 -24.38 61.24 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 113.313 0.856 . . . . 0.0 113.313 -173.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.548 ' N ' HD12 ' A' ' 118' ' ' LEU . 10.3 p -66.11 -21.69 66.36 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 123.124 0.57 . . . . 0.0 111.457 172.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -67.0 -21.25 65.96 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.246 0.93 . . . . 0.0 109.849 172.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 24.8 mt -96.82 -71.21 0.69 Allowed 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.12 0.968 . . . . 0.0 110.783 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 20.0 mt -69.06 -13.33 62.38 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.995 1.109 . . . . 0.0 113.995 -169.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 31.2 m -100.22 27.26 5.77 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 120.243 1.383 . . . . 0.0 111.522 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -128.88 110.46 12.14 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.625 1.97 . . . . 0.0 106.104 172.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -60.24 -26.63 66.59 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 122.863 0.465 . . . . 0.0 111.453 -179.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -62.93 -47.49 82.99 Favored 'General case' 0 C--O 1.231 0.132 0 C-N-CA 123.619 0.768 . . . . 0.0 109.676 175.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -65.52 -44.16 94.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 123.982 0.913 . . . . 0.0 109.092 176.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 48.2 mt -56.12 -43.39 78.12 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 118.632 0.651 . . . . 0.0 111.487 -175.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -67.74 -40.47 84.15 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 118.052 0.387 . . . . 0.0 110.462 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.424 ' HB3' HD11 ' A' ' 143' ' ' ILE . 44.0 mt-30 -69.64 -33.08 72.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 118.749 0.704 . . . . 0.0 110.214 -176.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 19.1 mt -68.3 -56.77 7.43 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 170.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 35.7 mt -55.41 -26.22 40.47 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -173.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 74.4 p -101.57 6.78 42.31 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.402 1.081 . . . . 0.0 112.338 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.31 112.7 1.65 Allowed 'General case' 0 C--N 1.342 0.264 0 C-N-CA 124.845 1.258 . . . . 0.0 110.493 178.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 7.4 m -70.0 -24.81 63.36 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.253 0.621 . . . . 0.0 112.054 177.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 15.5 m -150.59 158.97 44.77 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.111 0.964 . . . . 0.0 110.16 -169.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -51.15 -39.34 56.08 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.949 1.7 . . . . 0.0 111.1 176.117 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -57.25 -35.36 69.63 Favored 'General case' 0 C--O 1.227 -0.103 0 C-N-CA 123.13 0.572 . . . . 0.0 112.384 -179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 23.3 tp60 -80.44 -27.71 37.88 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 119.426 1.012 . . . . 0.0 110.413 -177.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 27.4 mt -66.15 -50.44 63.93 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.526 1.057 . . . . 0.0 108.387 170.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.12 -33.75 67.68 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.934 0.894 . . . . 0.0 113.15 174.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.76 -42.53 99.73 Favored 'General case' 0 N--CA 1.463 0.177 0 O-C-N 121.209 -0.932 . . . . 0.0 110.868 177.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.424 HD11 ' HB3' ' A' ' 130' ' ' GLN . 96.6 mt -69.15 -35.41 68.18 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.1 mm -58.26 -53.82 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 169.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 24.7 m -63.96 -27.0 68.84 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 122.68 0.392 . . . . 0.0 111.578 -170.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -59.82 -27.38 66.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.663 1.585 . . . . 0.0 113.404 175.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.851 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 -174.64 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 tpt . . . . . 0 N--CA 1.486 1.354 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -67.05 112.39 4.36 Favored 'General case' 0 N--CA 1.457 -0.121 0 N-CA-C 104.873 -2.269 . . . . 0.0 104.873 168.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -48.53 -43.51 35.43 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.983 0.913 . . . . 0.0 110.377 -176.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -49.42 -24.36 1.94 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.685 1.994 . . . . 0.0 113.902 -179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -59.42 -26.85 65.51 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 119.291 0.951 . . . . 0.0 112.337 177.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -100.44 -15.86 17.77 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.098 0.959 . . . . 0.0 112.902 -174.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -103.09 98.32 11.52 Favored Pre-proline 0 N--CA 1.471 0.624 0 CA-C-N 120.879 1.672 . . . . 0.0 106.985 -173.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.5 -60.43 0.31 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.696 2.264 . . . . 0.0 113.434 -171.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.408 ' C ' ' H ' ' A' ' 11' ' ' SER . 54.9 tt0 -165.97 -87.02 0.02 OUTLIER 'General case' 0 C--O 1.232 0.157 0 C-N-CA 123.592 0.757 . . . . 0.0 111.621 -170.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 13.2 m -67.87 8.76 0.35 Allowed 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.337 1.455 . . . . 0.0 111.754 176.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.408 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -65.63 -25.54 67.42 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 124.99 1.316 . . . . 0.0 111.905 -174.926 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.2 mp -98.23 140.0 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.975 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 177.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.0 m -154.39 158.36 39.91 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 121.483 0.659 . . . . 0.0 110.606 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.5 t -128.33 145.46 35.36 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 173.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.1 mm -138.76 140.04 39.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 104.654 -2.351 . . . . 0.0 104.654 -169.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 75.3 t60 -71.34 -49.52 41.63 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 119.269 0.941 . . . . 0.0 109.303 171.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.0 p -159.4 144.24 15.48 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.5 156.87 25.07 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 169.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.7 ttpt -58.75 -42.07 87.99 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 122.878 0.471 . . . . 0.0 110.653 175.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -165.22 177.69 7.46 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 128.212 2.605 . . . . 0.0 107.214 173.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.81 -37.07 65.65 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.227 1.811 . . . . 0.0 114.036 175.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.403 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.6 mt-30 -62.6 -50.35 71.6 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 120.401 1.455 . . . . 0.0 108.687 173.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -60.55 -32.45 71.52 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 122.951 0.5 . . . . 0.0 111.416 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.36 -37.86 86.27 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 121.575 -0.703 . . . . 0.0 110.158 -178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.51 -47.28 89.87 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 170.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -58.03 -49.64 76.15 Favored 'General case' 0 C--N 1.334 -0.082 0 C-N-CA 123.222 0.609 . . . . 0.0 110.657 -174.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 13.0 m-85 -62.82 -28.69 70.18 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.568 1.147 . . . . 0.0 111.626 174.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 45.2 m -76.51 -15.18 59.94 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.718 1.145 . . . . 0.0 112.766 177.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.94 -12.49 4.7 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -171.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.7 p -55.75 -34.19 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.405 0 CA-C-N 120.525 1.511 . . . . 0.0 112.069 -176.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 11.9 m -66.84 -41.61 87.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.385 -0.822 . . . . 0.0 110.253 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 97.0 mt -65.74 -38.45 89.15 Favored 'General case' 0 C--N 1.34 0.162 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 46.2 tp -60.65 -49.86 75.82 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 123.534 0.734 . . . . 0.0 110.316 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -64.92 -33.2 75.45 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.398 1.079 . . . . 0.0 112.221 -176.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -79.86 -0.37 34.47 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.654 1.182 . . . . 0.0 111.876 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 53.82 32.07 14.29 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.24 1.816 . . . . 0.0 113.284 -170.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -68.31 -24.88 64.89 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 120.819 -1.175 . . . . 0.0 109.709 168.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.6 pt -144.07 168.72 10.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 126.235 1.814 . . . . 0.0 110.016 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 97.3 p -96.11 172.56 7.91 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.807 1.243 . . . . 0.0 109.845 169.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.27 -33.05 74.49 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.267 -0.896 . . . . 0.0 110.557 171.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -61.27 -40.25 93.41 Favored 'General case' 0 C--N 1.342 0.251 0 O-C-N 121.97 -0.456 . . . . 0.0 110.684 179.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -54.28 -49.48 69.49 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.009 0.524 . . . . 0.0 110.154 177.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 45.2 mt -59.72 -49.2 84.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 C-N-CA 123.644 0.778 . . . . 0.0 109.246 179.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -68.5 -26.87 65.68 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 118.165 -0.921 . . . . 0.0 111.995 -174.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.29 -40.95 83.29 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.566 1.076 . . . . 0.0 110.683 171.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.06 -51.72 36.99 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.403 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.9 mttt -58.52 -44.03 89.36 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 -175.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -64.28 -46.24 84.54 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.774 0.83 . . . . 0.0 111.275 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.0 m -64.05 -35.79 81.88 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 122.801 0.44 . . . . 0.0 110.76 176.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 96.8 m -63.31 -46.38 86.94 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.746 0.818 . . . . 0.0 109.827 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.03 -45.94 95.26 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 118.632 0.651 . . . . 0.0 109.698 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -71.69 -32.74 68.16 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.933 0.716 . . . . 0.0 112.933 -170.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -138.62 -56.46 0.63 Allowed 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.152 0.581 . . . . 0.0 111.058 -168.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 155.54 167.41 17.04 Favored Glycine 0 CA--C 1.531 1.071 0 N-CA-C 109.644 -1.383 . . . . 0.0 109.644 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -44.99 138.91 8.54 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.647 2.898 . . . . 0.0 112.79 176.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -52.17 -37.39 54.49 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.077 0.951 . . . . 0.0 112.827 -175.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -150.65 156.1 40.68 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 26.3 mm -137.04 140.03 43.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 102.643 -3.095 . . . . 0.0 102.643 178.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.586 HD12 HG12 ' A' ' 63' ' ' VAL . 30.7 mt -110.39 -40.46 4.64 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -168.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -168.38 165.03 7.82 Favored Pre-proline 0 C--O 1.236 0.384 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -169.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -47.92 113.03 0.67 Allowed 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.827 2.351 . . . . 0.0 110.756 169.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.16 5.78 75.99 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-O 117.81 -1.55 . . . . 0.0 114.848 177.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.586 HG12 HD12 ' A' ' 59' ' ' LEU . 19.0 t -135.3 133.95 52.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-N 120.92 2.36 . . . . 0.0 109.524 -171.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -133.65 166.77 21.84 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.786 1.635 . . . . 0.0 110.281 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.525 ' HB2' HD11 ' A' ' 59' ' ' LEU . 33.5 ttp -147.5 82.44 8.13 Favored Pre-proline 0 C--O 1.225 -0.195 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 170.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -58.76 -91.21 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.312 0 C-N-CA 123.036 2.491 . . . . 0.0 114.43 -174.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . 0.301 0.2 OUTLIER 47.78 178.18 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.578 2.351 . . . . 0.0 114.753 -168.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.7 167.94 19.92 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 125.281 1.432 . . . . 0.0 107.848 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 25.1 mtm105 -60.74 150.57 75.61 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-O 118.575 -0.726 . . . . 0.0 109.046 174.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -45.63 -45.14 16.73 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 123.634 2.889 . . . . 0.0 112.755 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -61.71 -15.55 41.48 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.219 1.408 . . . . 0.0 113.643 -176.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.5 m -79.63 -4.72 52.91 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.518 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 131.49 18.64 1.27 Allowed Glycine 0 CA--C 1.523 0.579 0 CA-C-O 118.943 -0.92 . . . . 0.0 113.591 174.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.0 144.2 56.34 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 119.087 1.443 . . . . 0.0 107.645 169.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.9 mt -123.69 -32.63 3.3 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 124.313 1.045 . . . . 0.0 110.158 -173.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -143.19 170.85 14.97 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.415 1.886 . . . . 0.0 107.468 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 97.5 m -103.17 122.23 44.28 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.464 0.706 . . . . 0.0 110.381 -177.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.11 -177.23 38.65 Favored Glycine 0 CA--C 1.537 1.422 0 C-N-CA 126.017 1.77 . . . . 0.0 111.052 -175.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.607 ' SD ' HD21 ' A' ' 118' ' ' LEU . 51.4 mtt -149.15 169.83 19.82 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.594 1.697 . . . . 0.0 112.065 -171.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 8.9 p -146.86 168.08 22.32 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.859 1.264 . . . . 0.0 109.793 174.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.555 HD22 HD11 ' A' ' 144' ' ' ILE . 24.5 tp -153.98 106.78 2.87 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.797 1.639 . . . . 0.0 106.795 -172.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 65.5 m -122.7 140.9 52.36 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 123.79 0.836 . . . . 0.0 108.77 -169.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.4 tt -133.67 130.47 38.26 Favored 'General case' 0 C--N 1.34 0.159 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 178.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.3 mp -110.32 119.45 39.28 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 125.744 1.617 . . . . 0.0 107.924 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -63.1 -36.15 82.62 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 118.588 0.631 . . . . 0.0 112.178 -177.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -91.05 -17.1 26.79 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.811 1.245 . . . . 0.0 111.919 177.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 68.1 -179.93 18.18 Favored Glycine 0 CA--C 1.534 1.237 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 -168.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.74 162.94 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 169.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -121.09 83.82 2.14 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-O 122.295 1.045 . . . . 0.0 110.605 -169.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -50.71 143.96 13.74 Favored Pre-proline 0 CA--C 1.538 0.507 0 CA-C-N 114.317 -1.31 . . . . 0.0 112.212 174.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -67.94 152.78 76.63 Favored 'Trans proline' 0 CA--C 1.536 0.622 0 C-N-CA 122.107 1.871 . . . . 0.0 109.945 169.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.9 -44.37 2.32 Favored Glycine 0 CA--C 1.531 1.041 0 C-N-CA 125.316 1.436 . . . . 0.0 112.422 176.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.18 140.67 31.7 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 126.895 2.078 . . . . 0.0 110.55 169.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -73.73 -41.63 62.28 Favored 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -169.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -146.52 151.72 43.88 Favored Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 124.737 1.215 . . . . 0.0 110.194 -175.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -61.94 155.15 56.9 Favored 'Trans proline' 0 N--CA 1.456 -0.715 0 C-N-CA 123.155 2.57 . . . . 0.0 112.593 -169.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 47.5 mm -112.43 136.95 47.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.352 0 C-N-CA 124.735 1.214 . . . . 0.0 107.876 -171.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -113.74 -9.71 13.12 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 117.192 -1.385 . . . . 0.0 110.973 175.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.9 mt -136.37 138.94 42.12 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 120.582 1.537 . . . . 0.0 111.309 178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.5 mp -137.02 101.46 4.57 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.428 HG21 HD22 ' A' ' 118' ' ' LEU . 1.7 mp -77.05 146.43 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 169.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -132.73 160.06 23.68 Favored Glycine 0 N--CA 1.451 -0.33 0 N-CA-C 109.035 -1.626 . . . . 0.0 109.035 178.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.519 HD23 ' N ' ' A' ' 104' ' ' SER . 1.1 tt -155.04 150.0 26.79 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 105.119 -2.178 . . . . 0.0 105.119 -171.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.519 ' N ' HD23 ' A' ' 103' ' ' LEU . 11.0 p -143.0 141.95 31.48 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 127.226 2.211 . . . . 0.0 105.084 169.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -149.23 130.22 14.37 Favored 'General case' 0 CA--C 1.511 -0.524 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -173.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.29 -22.96 57.35 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 123.399 0.437 . . . . 0.0 111.428 -175.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -139.41 155.76 47.42 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.778 0.831 . . . . 0.0 110.32 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.87 -34.24 71.4 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.684 0.793 . . . . 0.0 112.973 -177.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -77.28 -32.16 55.34 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.1 0.864 . . . . 0.0 111.102 177.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.3 m -60.48 -41.7 94.78 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 169.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -58.36 -47.3 84.24 Favored 'General case' 0 C--O 1.225 -0.21 0 C-N-CA 124.68 1.192 . . . . 0.0 110.71 173.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 15.1 mm -59.69 -53.03 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -63.14 -37.04 94.27 Favored Glycine 0 CA--C 1.528 0.891 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 -177.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.432 ' CB ' HD21 ' A' ' 103' ' ' LEU . . . -66.0 -50.77 63.11 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 124.641 1.177 . . . . 0.0 110.53 177.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 mm -54.71 -45.54 73.19 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -71.28 -10.32 59.56 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.674 0.79 . . . . 0.0 113.056 -177.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.23 -42.5 14.62 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 169.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.607 HD21 ' SD ' ' A' ' 79' ' ' MET . 83.8 mt -63.77 -32.99 74.67 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 117.804 -1.093 . . . . 0.0 110.2 178.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 13.8 m -51.17 -28.88 12.23 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 171.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -67.9 -22.82 65.06 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.634 1.106 . . . . 0.0 110.845 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 49.6 mt -108.03 -60.81 1.67 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.744 1.218 . . . . 0.0 109.874 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.498 HD13 HD13 ' A' ' 59' ' ' LEU . 0.1 OUTLIER -52.14 -38.73 58.48 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 127.679 2.392 . . . . 0.0 114.19 178.098 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 56.5 m -95.06 24.99 4.45 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.481 1.037 . . . . 0.0 111.664 -178.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 72.5 mm-40 -133.32 101.91 5.35 Favored 'General case' 0 CA--C 1.516 -0.358 0 C-N-CA 124.101 0.96 . . . . 0.0 108.808 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -58.16 -28.55 64.83 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.801 -179.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.35 -43.15 91.75 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.278 0.631 . . . . 0.0 110.049 176.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.56 -44.4 86.44 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 174.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.8 mt -56.29 -37.88 70.47 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 119.101 0.864 . . . . 0.0 111.319 -176.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -68.35 -40.33 81.57 Favored 'General case' 0 N--CA 1.452 -0.35 0 CA-C-N 118.907 0.776 . . . . 0.0 111.109 175.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -69.03 -34.76 75.75 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 118.797 0.726 . . . . 0.0 109.805 -177.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -65.96 -55.15 18.3 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 169.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 35.0 mt -56.19 -16.11 4.79 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 113.901 1.075 . . . . 0.0 113.901 -176.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 42.8 p -112.0 7.62 19.91 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.95 1.3 . . . . 0.0 110.806 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.49 117.78 6.16 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 125.631 1.572 . . . . 0.0 110.348 176.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 19.8 m -76.99 -15.36 59.66 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.721 0.808 . . . . 0.0 112.157 175.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 73.5 p -154.92 164.65 38.56 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 119.035 0.834 . . . . 0.0 110.986 -170.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 50.7 mp0 -58.09 -37.11 73.88 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.856 0.862 . . . . 0.0 109.494 169.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -57.91 -45.53 86.35 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 122.659 0.384 . . . . 0.0 110.455 178.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.68 -33.87 76.9 Favored 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 112.544 0.572 . . . . 0.0 112.544 178.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.3 mt -67.55 -51.49 50.14 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.065 0.848 . . . . 0.0 109.074 175.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.72 -24.4 67.76 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.096 0.958 . . . . 0.0 113.511 177.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -61.07 -44.67 97.02 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 120.712 -1.243 . . . . 0.0 109.776 172.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 89.9 mt -67.35 -35.51 73.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 124.166 0.986 . . . . 0.0 109.368 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . 0.555 HD11 HD22 ' A' ' 81' ' ' LEU . 41.2 mm -56.22 -53.77 35.59 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 169.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 20.3 m -64.66 -33.02 74.95 Favored 'General case' 0 N--CA 1.447 -0.594 0 O-C-N 123.642 0.589 . . . . 0.0 110.624 -171.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -58.51 -45.06 89.55 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 125.779 1.631 . . . . 0.0 112.707 176.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.038 0 N-CA-C 110.443 -1.063 . . . . 0.0 110.443 -169.785 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 tpt . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -65.91 110.11 2.76 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 105.597 -2.001 . . . . 0.0 105.597 168.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -53.38 -41.11 65.58 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.618 0.767 . . . . 0.0 110.447 -175.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.4 p -53.26 -21.62 5.68 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.583 1.553 . . . . 0.0 113.549 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -59.82 -25.0 64.61 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 119.664 1.12 . . . . 0.0 112.264 174.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -100.72 -10.97 20.33 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 117.57 -1.205 . . . . 0.0 113.126 -174.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -113.78 83.32 7.3 Favored Pre-proline 0 N--CA 1.474 0.768 0 CA-C-N 121.52 1.964 . . . . 0.0 107.479 -174.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -55.74 -54.18 4.53 Favored 'Trans proline' 0 C--N 1.351 0.7 0 C-N-CA 123.864 3.042 . . . . 0.0 116.277 -169.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.466 ' C ' ' H ' ' A' ' 11' ' ' SER . 42.0 tt0 -157.88 -93.34 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.573 0.624 . . . . 0.0 112.589 -169.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 m -68.52 13.43 0.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.432 1.493 . . . . 0.0 111.365 177.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.466 ' H ' ' C ' ' A' ' 9' ' ' GLU . 11.2 m -62.03 -29.17 70.1 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 125.448 1.499 . . . . 0.0 111.229 -169.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.3 mp -105.84 129.93 58.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 -175.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 31.1 m -144.2 141.56 29.97 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 123.388 0.43 . . . . 0.0 110.351 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.4 t -112.6 135.41 52.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 169.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.41 HG22 ' H ' ' A' ' 17' ' ' SER . 30.9 mt -136.75 145.52 30.06 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -169.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.459 ' CE1' HE22 ' A' ' 86' ' ' GLN . 32.5 t-80 -59.4 -46.29 89.11 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.99 0.916 . . . . 0.0 111.82 174.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 15' ' ' ILE . 18.5 p -168.14 150.94 5.56 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.541 1.136 . . . . 0.0 108.161 -175.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.21 144.26 30.8 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 168.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tppt? -72.32 -30.01 64.36 Favored 'General case' 0 CA--C 1.534 0.362 0 O-C-N 122.096 -0.378 . . . . 0.0 111.955 -175.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -163.81 173.18 13.1 Favored 'General case' 0 CA--C 1.519 -0.218 0 C-N-CA 127.388 2.275 . . . . 0.0 106.123 -177.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -66.6 -33.95 76.8 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 119.252 -0.404 . . . . 0.0 110.504 169.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.412 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.4 mt-30 -59.06 -48.03 83.09 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.447 -0.946 . . . . 0.0 108.447 169.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -65.54 -33.56 76.21 Favored 'General case' 0 C--O 1.223 -0.292 0 O-C-N 121.788 -0.57 . . . . 0.0 111.52 -178.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.61 -37.77 88.6 Favored 'General case' 0 N--CA 1.447 -0.589 0 O-C-N 121.81 -0.556 . . . . 0.0 109.686 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.1 -45.85 85.8 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 170.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -56.87 -44.95 82.75 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 123.035 0.534 . . . . 0.0 110.426 -174.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -67.62 -32.79 73.75 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 118.101 -0.952 . . . . 0.0 111.734 174.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.3 m -61.99 -21.16 64.61 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.64 1.109 . . . . 0.0 112.274 173.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.6 mmt -122.2 -23.94 5.2 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 -169.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -59.5 -34.57 55.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-N 120.912 1.687 . . . . 0.0 112.272 -170.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.1 m -63.1 -29.64 70.96 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.34 0.973 . . . . 0.0 111.723 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 71.5 mt -81.07 -40.66 23.8 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.153 0.981 . . . . 0.0 109.265 174.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.5 tp -56.58 -40.71 75.7 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.711 0.804 . . . . 0.0 110.628 177.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -66.54 -27.96 68.16 Favored 'General case' 0 C--O 1.232 0.162 0 C-N-CA 124.918 1.287 . . . . 0.0 113.068 -172.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 18.2 mmtt -101.87 16.95 24.35 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 117.971 0.351 . . . . 0.0 110.486 173.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.423 0.0 OUTLIER 44.28 42.66 5.36 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 127.26 2.224 . . . . 0.0 115.807 -170.122 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -68.14 -19.29 64.81 Favored 'General case' 0 N--CA 1.471 0.618 0 O-C-N 120.974 -1.079 . . . . 0.0 110.193 168.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.9 pt -143.26 174.14 5.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 127.081 2.152 . . . . 0.0 108.125 -176.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 m -111.75 159.22 18.47 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.007 1.723 . . . . 0.0 107.722 171.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -60.99 -30.65 70.4 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.971 -1.08 . . . . 0.0 111.901 -176.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -57.97 -36.73 73.0 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 121.705 -0.622 . . . . 0.0 111.92 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -60.3 -45.11 94.51 Favored 'General case' 0 CA--C 1.527 0.09 0 C-N-CA 123.681 0.792 . . . . 0.0 110.015 -177.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.8 mt -59.1 -51.05 77.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 C-N-CA 124.725 1.21 . . . . 0.0 108.481 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.8 tp60 -67.97 -26.0 65.71 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.026 -0.988 . . . . 0.0 111.775 -175.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.33 -43.36 96.49 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 119.771 1.168 . . . . 0.0 110.658 173.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.2 mt -67.74 -48.81 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.205 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.4 mttt -59.34 -45.5 91.19 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.195 0.452 . . . . 0.0 109.841 -175.717 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.3 -42.78 96.21 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 124.222 1.009 . . . . 0.0 111.106 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.0 m -64.36 -42.9 95.97 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.135 0.425 . . . . 0.0 110.235 176.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 98.3 m -58.79 -44.01 90.61 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.573 1.149 . . . . 0.0 111.022 176.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 65.8 mt -68.35 -40.27 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 123.753 0.821 . . . . 0.0 109.979 177.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -64.37 -34.67 78.7 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 123.838 0.855 . . . . 0.0 113.019 -173.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -146.41 -54.02 0.25 Allowed 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 122.87 0.468 . . . . 0.0 111.149 -168.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 160.61 168.13 22.09 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -47.09 145.34 7.6 Favored 'Trans proline' 0 N--CA 1.459 -0.548 0 C-N-CA 123.203 2.602 . . . . 0.0 113.19 173.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -103.73 -8.58 19.76 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.979 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -142.59 83.3 1.81 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.41 1.084 . . . . 0.0 108.376 -169.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.3 mm -125.65 127.02 71.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 103.713 -2.699 . . . . 0.0 103.713 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 6.9 mp -120.15 -21.99 6.8 Favored 'General case' 0 C--O 1.231 0.107 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -169.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -155.56 159.36 31.72 Favored Pre-proline 0 C--O 1.236 0.368 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 170.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -62.24 104.83 0.36 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 121.682 1.588 . . . . 0.0 108.99 170.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.56 -10.04 16.68 Favored Glycine 0 CA--C 1.533 1.176 0 CA-C-O 117.958 -1.468 . . . . 0.0 113.973 -177.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.8 t -132.91 123.06 47.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 119.632 1.716 . . . . 0.0 108.863 -170.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -117.73 167.17 11.61 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 126.114 1.766 . . . . 0.0 109.12 174.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.9 ttm -137.58 60.25 24.68 Favored Pre-proline 0 CA--C 1.548 0.888 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 177.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -53.53 141.79 61.63 Favored 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 122.262 1.975 . . . . 0.0 114.429 -172.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -175.75 156.66 1.88 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.552 2.741 . . . . 0.0 106.753 -171.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.62 162.03 33.86 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.863 1.665 . . . . 0.0 107.366 169.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 90.0 mtm-85 -52.52 141.94 32.62 Favored Pre-proline 0 CA--C 1.537 0.454 0 CA-C-O 117.676 -1.154 . . . . 0.0 108.868 176.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -45.69 -41.13 19.29 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.818 3.012 . . . . 0.0 112.916 179.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -62.2 -13.06 23.73 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.465 1.506 . . . . 0.0 113.253 -177.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 62.1 m -78.25 -1.82 34.85 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.649 0.78 . . . . 0.0 111.583 177.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.41 17.46 2.4 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-O 118.433 -1.204 . . . . 0.0 112.96 172.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.58 145.83 55.58 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 119.3 1.55 . . . . 0.0 108.724 169.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.1 mt -128.46 -32.28 2.2 Favored 'General case' 0 C--N 1.332 -0.196 0 C-N-CA 124.471 1.109 . . . . 0.0 110.425 -173.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -145.26 160.86 40.84 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 125.605 1.562 . . . . 0.0 108.438 176.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 82.2 m -94.54 127.76 40.7 Favored 'General case' 0 N--CA 1.442 -0.833 0 C-N-CA 123.195 0.598 . . . . 0.0 110.091 -176.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -170.82 -176.45 40.12 Favored Glycine 0 CA--C 1.534 1.223 0 C-N-CA 125.204 1.383 . . . . 0.0 110.683 -175.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 49.2 mtt -148.26 171.81 15.36 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 126.095 1.758 . . . . 0.0 111.059 -174.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -139.15 168.25 20.25 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.131 1.773 . . . . 0.0 108.586 174.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.477 HD22 HD11 ' A' ' 144' ' ' ILE . 13.3 tp -148.77 83.31 1.46 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.699 2.0 . . . . 0.0 107.397 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 55.7 m -86.51 142.57 28.25 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 176.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.2 tt -136.59 116.9 13.58 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 169.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -89.1 132.24 34.89 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 172.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -65.06 -29.24 70.12 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 169.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.459 HE22 ' CE1' ' A' ' 16' ' ' HIS . 32.1 mt-30 -130.29 75.66 1.67 Allowed 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 126.645 1.978 . . . . 0.0 107.331 -178.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -52.12 161.45 2.17 Favored Glycine 0 CA--C 1.525 0.716 0 C-N-CA 125.949 1.738 . . . . 0.0 113.835 175.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 48.9 t -127.6 147.58 32.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 C-N-CA 125.745 1.618 . . . . 0.0 107.426 -173.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -98.65 179.14 4.77 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -131.37 156.47 80.09 Favored Pre-proline 0 C--N 1.323 -0.558 0 C-N-CA 124.162 0.985 . . . . 0.0 111.744 -169.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -63.95 -1.95 4.06 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 123.475 2.783 . . . . 0.0 115.292 -174.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -143.73 23.62 2.14 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 124.339 0.971 . . . . 0.0 112.849 171.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -151.1 98.15 2.53 Favored 'General case' 0 N--CA 1.463 0.202 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 170.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -66.11 -23.33 66.48 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.901 1.281 . . . . 0.0 114.299 -169.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 43.8 tp10 -75.94 131.73 75.57 Favored Pre-proline 0 N--CA 1.436 -1.164 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 177.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -75.05 154.9 42.58 Favored 'Trans proline' 0 N--CA 1.448 -1.17 0 C-N-CA 122.218 1.945 . . . . 0.0 110.493 176.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 49.6 mm -117.35 124.72 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 106.515 -1.661 . . . . 0.0 106.515 -177.208 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -88.86 -33.34 17.38 Favored 'General case' 0 C--O 1.223 -0.316 0 CA-C-O 117.178 -1.391 . . . . 0.0 109.434 169.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 3.6 mt -116.19 131.11 57.04 Favored 'General case' 0 CA--C 1.507 -0.678 0 CA-C-N 120.034 1.288 . . . . 0.0 112.025 -169.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.4 mp -136.84 104.99 5.66 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.9 mp -87.51 112.34 23.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 175.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.18 153.88 47.15 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 109.43 -1.468 . . . . 0.0 109.43 172.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.43 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -147.27 133.97 19.97 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 105.203 -2.147 . . . . 0.0 105.203 169.176 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.43 ' N ' HD23 ' A' ' 103' ' ' LEU . 93.0 p -127.62 147.69 50.36 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 126.344 1.858 . . . . 0.0 106.925 168.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -147.25 132.87 18.79 Favored 'General case' 0 CA--C 1.513 -0.456 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -178.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.16 -22.74 60.44 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 122.721 0.408 . . . . 0.0 111.962 179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -144.42 155.82 43.93 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.678 0.791 . . . . 0.0 110.036 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.99 -35.36 74.87 Favored 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -177.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.22 -31.22 62.53 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 120.839 -1.163 . . . . 0.0 111.032 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.7 m -64.65 -39.05 93.01 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.937 -0.477 . . . . 0.0 110.136 170.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -58.84 -48.84 79.92 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 123.637 0.775 . . . . 0.0 109.873 172.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 16.0 mm -55.92 -53.83 33.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.25 -39.28 94.39 Favored Glycine 0 CA--C 1.53 1.002 0 CA-C-N 118.837 0.744 . . . . 0.0 112.03 -177.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.96 -53.3 27.19 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.459 1.104 . . . . 0.0 110.582 179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -51.35 -47.44 34.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.47 1.508 . . . . 0.0 108.637 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -67.62 -10.66 54.13 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.499 1.12 . . . . 0.0 112.555 -177.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -93.87 -46.17 7.31 Favored 'General case' 0 N--CA 1.442 -0.828 0 C-N-CA 123.973 0.909 . . . . 0.0 109.726 169.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.465 HD12 ' N ' ' A' ' 119' ' ' SER . 1.8 pp -72.66 -25.24 61.19 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 118.711 0.687 . . . . 0.0 112.108 -173.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.465 ' N ' HD12 ' A' ' 118' ' ' LEU . 4.9 p -61.18 -20.91 63.29 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.177 0.591 . . . . 0.0 112.152 172.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -65.7 -19.17 65.8 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.391 0.996 . . . . 0.0 110.098 172.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 36.5 mt -106.54 -63.29 1.29 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.639 1.576 . . . . 0.0 110.178 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -58.5 -23.85 59.03 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.533 1.933 . . . . 0.0 114.528 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.0 m -112.48 28.15 9.03 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 118.95 0.796 . . . . 0.0 110.165 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -132.89 102.57 5.69 Favored 'General case' 0 CA--C 1.516 -0.351 0 C-N-CA 123.863 0.865 . . . . 0.0 108.903 177.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -57.85 -26.92 62.72 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.938 -178.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -62.09 -45.0 95.45 Favored 'General case' 0 C--N 1.34 0.152 0 C-N-CA 123.893 0.877 . . . . 0.0 110.123 174.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -69.06 -46.35 78.6 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 CA-C-O 117.961 -1.019 . . . . 0.0 108.728 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 8.8 mp -50.56 -44.18 56.57 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 119.541 1.064 . . . . 0.0 112.672 -176.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -71.25 -34.38 70.68 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 118.63 0.65 . . . . 0.0 110.384 -178.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -72.76 -34.43 67.0 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 121.404 -0.81 . . . . 0.0 109.68 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 55.7 mt -65.6 -53.47 41.27 Favored 'General case' 0 C--O 1.223 -0.317 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 29.9 mt -56.78 -32.43 65.64 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -174.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 37.2 p -88.24 -0.53 57.22 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.076 0.95 . . . . 0.0 112.26 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -58.87 138.64 57.22 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 119.127 0.876 . . . . 0.0 110.178 176.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.0 m -124.57 9.07 8.35 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.943 1.297 . . . . 0.0 110.754 176.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 74.8 p -152.16 153.66 34.31 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.491 1.116 . . . . 0.0 108.916 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -62.21 -32.12 72.74 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 169.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -58.07 -40.99 82.42 Favored 'General case' 0 C--N 1.339 0.139 0 C-N-CA 123.191 0.597 . . . . 0.0 111.842 176.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 14.3 tp60 -74.56 -30.89 61.91 Favored 'General case' 0 N--CA 1.436 -1.163 0 CA-C-N 119.429 1.013 . . . . 0.0 110.738 -178.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 46.9 mt -68.77 -50.15 52.82 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 119.407 1.003 . . . . 0.0 108.924 173.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.36 -31.1 65.41 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.515 1.126 . . . . 0.0 112.892 174.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -61.93 -45.85 91.88 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 120.842 -1.161 . . . . 0.0 110.038 173.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 95.7 mt -65.49 -37.2 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 123.987 0.915 . . . . 0.0 109.739 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . 0.477 HD11 HD22 ' A' ' 81' ' ' LEU . 40.2 mm -56.24 -49.56 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-N 118.23 0.468 . . . . 0.0 110.128 169.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 39.2 m -66.84 -26.26 66.83 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -169.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 34.2 mtt180 -67.41 -34.86 78.11 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.776 0.717 . . . . 0.0 111.252 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.926 0 CA-C-O 117.815 -1.547 . . . . 0.0 110.375 -169.257 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 tpp . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.705 0.288 . . . . 0.0 111.143 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -66.34 106.45 1.71 Allowed 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 169.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -60.4 -42.9 96.88 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 175.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m -56.03 -24.04 36.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.41 1.084 . . . . 0.0 112.773 -178.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -62.81 -22.68 66.8 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 119.097 0.862 . . . . 0.0 112.688 175.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -106.0 -10.2 16.69 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-O 116.52 -1.705 . . . . 0.0 113.593 -170.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -115.47 91.01 27.34 Favored Pre-proline 0 N--CA 1.477 0.925 0 CA-C-N 122.729 2.513 . . . . 0.0 108.433 -174.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -42.07 -75.07 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.804 1 C-N-CA 125.537 4.158 . . . . 0.0 116.795 -171.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.472 ' C ' ' H ' ' A' ' 11' ' ' SER . 8.0 tp10 -162.09 -76.69 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 124.032 0.933 . . . . 0.0 111.114 -173.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.1 m -66.86 6.35 0.51 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.544 1.537 . . . . 0.0 111.803 175.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.472 ' H ' ' C ' ' A' ' 9' ' ' GLU . 3.8 m -74.91 1.52 12.55 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 128.452 2.701 . . . . 0.0 113.247 -169.04 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.5 mt -130.69 131.82 64.55 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 N-CA-C 105.316 -2.105 . . . . 0.0 105.316 -172.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.5 p -151.61 155.6 38.73 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 122.052 0.929 . . . . 0.0 111.347 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -127.59 136.1 61.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 103.297 -2.853 . . . . 0.0 103.297 169.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.1 mt -134.89 147.39 29.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 N-CA-C 106.46 -1.682 . . . . 0.0 106.46 -169.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 -63.24 -47.93 80.37 Favored 'General case' 0 CA--C 1.535 0.383 0 O-C-N 121.938 -0.476 . . . . 0.0 110.631 174.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 p -166.51 147.42 6.23 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -172.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.15 149.89 30.39 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 107.393 -1.336 . . . . 0.0 107.393 169.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -60.19 -41.03 92.07 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.02 0.528 . . . . 0.0 110.818 178.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -166.02 179.9 5.55 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 127.09 2.156 . . . . 0.0 107.658 173.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -64.61 -31.6 72.89 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.021 0.929 . . . . 0.0 112.567 -178.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.433 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.2 mt-30 -62.95 -49.43 74.76 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 120.265 1.393 . . . . 0.0 107.872 169.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -60.47 -34.77 74.51 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 121.887 -0.508 . . . . 0.0 111.67 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.63 -35.52 79.85 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.936 -0.478 . . . . 0.0 110.124 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -71.27 -45.85 68.24 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 172.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -55.58 -44.71 77.17 Favored 'General case' 0 C--O 1.225 -0.203 0 O-C-N 121.747 -0.596 . . . . 0.0 110.8 179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -65.76 -33.35 75.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.753 174.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.5 m -63.32 -19.91 65.03 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 119.638 1.108 . . . . 0.0 112.479 172.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.8 mmt -124.68 -20.97 4.92 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -168.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -59.66 -36.99 68.66 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 120.788 1.631 . . . . 0.0 111.916 -169.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.3 m -66.57 -19.79 65.86 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.941 0.791 . . . . 0.0 112.183 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.9 mt -86.03 -44.44 12.3 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 123.927 0.891 . . . . 0.0 109.072 170.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -56.38 -42.92 78.69 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.959 0.904 . . . . 0.0 110.772 -178.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -67.59 -23.03 65.34 Favored 'General case' 0 C--N 1.333 -0.149 0 C-N-CA 125.758 1.623 . . . . 0.0 113.942 -170.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -115.38 26.44 10.07 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 122.558 0.343 . . . . 0.0 110.454 171.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 60.89 27.15 17.0 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 170.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -67.21 -22.15 65.73 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.133 -0.979 . . . . 0.0 110.814 169.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 pt -143.35 170.27 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 126.165 1.786 . . . . 0.0 108.879 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.6 m -102.63 158.79 15.99 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.304 1.841 . . . . 0.0 108.385 171.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.29 -32.43 70.03 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 121.227 -0.92 . . . . 0.0 112.372 -178.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.3 t30 -58.23 -32.83 68.7 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.764 -0.585 . . . . 0.0 111.954 175.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -60.74 -42.65 97.79 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.586 0.754 . . . . 0.0 110.435 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -59.69 -50.8 78.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.3 tp60 -69.11 -27.58 65.72 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.59 -0.719 . . . . 0.0 111.915 -173.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.17 -40.98 78.39 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.016 0.826 . . . . 0.0 110.757 174.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 22.5 mt -72.6 -49.23 42.58 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.433 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 90.8 mttt -58.36 -41.24 84.27 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 119.448 -0.31 . . . . 0.0 110.443 -175.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -59.39 -52.74 64.32 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.463 0.705 . . . . 0.0 111.051 -173.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.5 m -64.64 -40.69 95.91 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 122.789 0.436 . . . . 0.0 110.481 175.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 87.1 m -56.0 -39.23 71.58 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 119.098 -0.477 . . . . 0.0 111.671 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 90.3 mt -81.39 -47.03 20.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-N 118.808 0.731 . . . . 0.0 109.75 -179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 20.2 m-80 -74.31 -31.97 62.69 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -169.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -126.63 -44.25 1.68 Allowed 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.005 0.922 . . . . 0.0 110.844 -169.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 138.0 163.53 9.65 Favored Glycine 0 CA--C 1.529 0.965 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 -177.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -61.08 147.93 94.29 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 122.122 1.881 . . . . 0.0 109.599 176.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.7 p90 -135.05 12.72 3.6 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -169.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -134.01 75.64 1.61 Allowed 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 125.293 1.437 . . . . 0.0 107.483 169.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 50.2 mm -119.66 139.0 48.47 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 N-CA-C 105.416 -2.068 . . . . 0.0 105.416 177.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mp -130.77 -25.18 2.35 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -169.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -158.5 161.86 27.74 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 173.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -48.64 118.38 3.34 Favored 'Trans proline' 0 N--CA 1.456 -0.686 0 C-N-CA 122.775 2.317 . . . . 0.0 110.807 169.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 84.98 3.19 88.0 Favored Glycine 0 CA--C 1.533 1.199 0 CA-C-O 117.799 -1.556 . . . . 0.0 114.931 178.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 26.2 t -132.03 126.19 56.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-N 120.067 1.934 . . . . 0.0 108.882 -172.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.07 168.38 15.43 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 126.155 1.782 . . . . 0.0 109.768 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.45 ' CE ' HD11 ' A' ' 118' ' ' LEU . 5.4 ttm -137.31 60.41 26.97 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.035 0.934 . . . . 0.0 110.397 175.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -57.13 123.57 14.14 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 121.911 1.741 . . . . 0.0 110.362 -174.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.54 161.41 3.27 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 127.546 2.338 . . . . 0.0 106.855 -169.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -136.43 173.67 11.46 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.99 1.316 . . . . 0.0 109.343 -173.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 67.3 mtp85 -59.04 154.71 37.73 Favored Pre-proline 0 CA--C 1.537 0.446 0 CA-C-O 118.702 -0.666 . . . . 0.0 109.608 172.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -58.13 -39.59 84.08 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.204 1.936 . . . . 0.0 109.517 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -64.12 -12.92 44.12 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.558 1.543 . . . . 0.0 113.196 -177.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 73.6 m -77.17 -3.24 38.5 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.079 0.854 . . . . 0.0 111.784 177.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.85 19.6 1.98 Allowed Glycine 0 C--N 1.336 0.568 0 CA-C-O 118.245 -1.308 . . . . 0.0 112.689 173.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.75 145.32 56.13 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 119.502 1.651 . . . . 0.0 108.984 169.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -130.34 -30.57 1.92 Allowed 'General case' 0 C--N 1.333 -0.15 0 C-N-CA 124.0 0.92 . . . . 0.0 111.047 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 mttt -148.04 155.6 41.68 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.939 1.296 . . . . 0.0 107.93 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.443 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 89.8 m -87.37 130.65 34.56 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 122.957 0.503 . . . . 0.0 111.592 -176.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -177.04 -177.98 46.4 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 125.173 1.368 . . . . 0.0 110.82 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.408 ' HG2' ' HA ' ' A' ' 103' ' ' LEU . 13.3 mtm -149.99 171.83 16.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 127.195 2.198 . . . . 0.0 109.731 -176.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 66.2 m -151.09 167.95 26.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.705 1.202 . . . . 0.0 109.273 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.7 tp -144.94 98.87 3.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 126.445 1.898 . . . . 0.0 108.468 -169.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 28.1 m -103.97 143.47 32.83 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.408 1.083 . . . . 0.0 108.69 -178.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 7.4 tt -133.84 134.29 42.61 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 107.999 -1.111 . . . . 0.0 107.999 171.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -103.24 133.82 47.69 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 124.045 0.938 . . . . 0.0 108.653 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -67.62 -29.61 68.98 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 168.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -130.71 82.53 2.06 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 127.099 2.16 . . . . 0.0 106.796 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -46.98 157.61 0.53 Allowed Glycine 0 CA--C 1.526 0.743 0 CA-C-N 113.083 -1.871 . . . . 0.0 113.743 176.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 95.5 t -123.8 150.68 28.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 -174.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -112.19 98.46 7.33 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 124.107 0.963 . . . . 0.0 110.663 -168.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -51.63 141.67 24.75 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 124.322 1.049 . . . . 0.0 110.827 169.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -73.1 68.27 4.06 Favored 'Trans proline' 0 CA--C 1.545 1.059 0 C-N-CA 124.165 3.244 . . . . 0.0 112.665 -176.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 167.8 -9.48 0.05 OUTLIER Glycine 0 CA--C 1.533 1.218 0 CA-C-O 118.719 -1.045 . . . . 0.0 114.467 173.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -71.74 -176.39 1.63 Allowed 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.319 1.559 . . . . 0.0 110.384 172.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -93.81 -27.99 16.14 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.367 -0.833 . . . . 0.0 111.043 169.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -150.38 167.7 12.48 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 124.328 1.051 . . . . 0.0 112.805 -173.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -60.38 143.73 99.49 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 123.522 2.815 . . . . 0.0 112.49 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 25.5 mm -92.46 131.38 39.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 173.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -101.06 -19.31 15.86 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-O 116.351 -1.785 . . . . 0.0 110.923 169.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 1.7 mt -130.48 134.35 47.01 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-N 121.513 1.961 . . . . 0.0 111.887 -174.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.7 mp -139.86 109.78 6.41 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -174.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.8 mp -92.34 119.23 39.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 175.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -80.36 153.03 34.9 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 170.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.547 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -151.38 143.55 24.01 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 170.567 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.547 ' N ' HD23 ' A' ' 103' ' ' LEU . 79.4 p -142.73 146.31 34.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 168.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.625 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -144.91 145.94 31.79 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 118.915 0.78 . . . . 0.0 109.716 170.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.69 -13.11 59.71 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.538 -0.465 . . . . 0.0 111.351 -176.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -137.04 151.26 48.72 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.63 0.772 . . . . 0.0 110.024 175.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.29 -35.51 77.54 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.705 0.631 . . . . 0.0 112.705 -177.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -72.34 -30.03 64.37 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.119 -0.988 . . . . 0.0 110.946 176.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.442 ' HB2' ' HB1' ' A' ' 105' ' ' ALA . 20.0 m -66.94 -35.55 80.24 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.79 -0.569 . . . . 0.0 110.444 169.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.625 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 28.5 m-70 -62.19 -45.0 95.34 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 119.343 0.974 . . . . 0.0 109.85 170.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.1 mm -56.32 -52.03 56.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 118.946 0.794 . . . . 0.0 109.267 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.37 -39.69 95.08 Favored Glycine 0 CA--C 1.529 0.939 0 CA-C-N 118.945 0.793 . . . . 0.0 111.81 -177.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.65 -45.86 67.46 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.411 0.684 . . . . 0.0 110.874 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.6 mm -58.04 -46.23 88.04 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 C-N-CA 124.607 1.163 . . . . 0.0 108.167 176.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -68.21 -12.04 60.29 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.139 -0.975 . . . . 0.0 111.527 -177.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.57 -48.58 6.54 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 124.276 1.031 . . . . 0.0 109.546 173.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.45 HD11 ' CE ' ' A' ' 65' ' ' MET . 4.2 pp -68.83 -28.3 66.61 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.643 -177.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.7 m -61.7 -20.21 63.22 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 118.822 -0.609 . . . . 0.0 112.393 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -67.19 -14.49 62.95 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 119.611 1.096 . . . . 0.0 110.734 171.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 32.6 mt -111.68 -59.51 1.97 Allowed 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.683 1.593 . . . . 0.0 110.734 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.1 -37.25 74.16 Favored 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 124.669 1.188 . . . . 0.0 113.125 -178.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 42.3 m -100.7 25.46 7.84 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.557 0.343 . . . . 0.0 110.679 -172.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -133.95 99.08 4.33 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 124.676 1.191 . . . . 0.0 108.121 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -57.04 -27.28 61.53 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.476 0.71 . . . . 0.0 112.309 -178.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -64.0 -43.14 96.56 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 123.277 0.631 . . . . 0.0 110.065 175.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.3 mp -70.6 -42.83 78.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.383 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 175.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 55.2 mt -53.6 -40.43 65.68 Favored 'General case' 0 C--O 1.225 -0.192 0 CA-C-N 119.247 0.93 . . . . 0.0 112.262 -175.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -71.56 -33.99 69.59 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 118.847 0.748 . . . . 0.0 110.569 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 58.3 mt-30 -72.31 -33.74 67.6 Favored 'General case' 0 N--CA 1.452 -0.338 0 O-C-N 121.418 -0.801 . . . . 0.0 109.733 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 69.8 mt -66.19 -53.92 31.5 Favored 'General case' 0 C--O 1.222 -0.375 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 169.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 26.8 mt -55.78 -30.22 60.95 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.136 0.574 . . . . 0.0 112.54 -174.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 32.1 p -91.56 2.86 56.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.273 1.029 . . . . 0.0 112.131 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.81 104.26 0.81 Allowed 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.465 1.106 . . . . 0.0 110.564 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 11.7 m -69.05 -26.61 65.05 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.37 0.668 . . . . 0.0 111.78 175.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 18.9 m -148.17 159.28 44.11 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.271 1.428 . . . . 0.0 108.954 -172.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -54.43 -31.66 55.8 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.36 1.464 . . . . 0.0 112.021 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -56.05 -34.46 65.92 Favored 'General case' 0 C--O 1.227 -0.083 0 C-N-CA 123.298 0.639 . . . . 0.0 112.616 -177.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -80.98 -26.47 36.51 Favored 'General case' 0 N--CA 1.433 -1.322 0 CA-C-N 119.451 1.023 . . . . 0.0 110.547 -179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 82.1 mt -71.07 -48.86 50.18 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 173.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -54.85 -38.55 67.6 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.893 1.277 . . . . 0.0 112.711 171.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -59.16 -47.73 84.24 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 118.941 0.791 . . . . 0.0 110.196 175.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 67.2 mt -65.91 -37.01 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 C-N-CA 123.537 0.735 . . . . 0.0 110.292 -178.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 20.9 mm -57.32 -53.55 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 169.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 83.8 p -64.01 -29.5 70.65 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.129 0.49 . . . . 0.0 111.989 -169.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.2 ttm180 -57.93 -26.39 62.16 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.331 1.852 . . . . 0.0 113.342 176.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.876 0 N-CA-C 108.538 -1.825 . . . . 0.0 108.538 -177.684 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.3 tpt . . . . . 0 N--CA 1.488 1.433 0 N-CA-C 110.298 -0.26 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -67.15 114.56 6.0 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 169.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -55.32 -38.58 68.88 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 125.037 1.335 . . . . 0.0 110.038 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.86 -20.94 9.83 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.442 1.497 . . . . 0.0 112.891 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -68.84 -31.92 71.25 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 119.088 0.858 . . . . 0.0 112.508 175.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 -87.08 -27.14 23.32 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 118.486 -0.768 . . . . 0.0 112.765 -171.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -91.42 104.31 9.66 Favored Pre-proline 0 CA--C 1.542 0.651 0 N-CA-C 103.801 -2.666 . . . . 0.0 103.801 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -63.46 -68.85 0.04 OUTLIER 'Trans proline' 0 C--N 1.354 0.822 0 C-N-CA 122.099 1.866 . . . . 0.0 113.686 -168.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -164.09 161.16 22.27 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 126.358 1.863 . . . . 0.0 106.38 171.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.0 m 53.07 22.87 2.7 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.34 1.056 . . . . 0.0 112.949 173.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 49.4 m -114.56 24.05 12.19 Favored 'General case' 0 N--CA 1.457 -0.109 0 C-N-CA 125.406 1.482 . . . . 0.0 110.691 -169.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.8 mt -131.52 129.69 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 103.863 -2.643 . . . . 0.0 103.863 178.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.5 m -150.38 149.24 29.8 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.475 0.71 . . . . 0.0 111.109 -173.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.7 t -123.65 142.61 39.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 169.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.6 mt -142.27 148.91 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 126.316 1.846 . . . . 0.0 106.168 -169.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -73.6 -46.58 46.23 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 121.553 -0.717 . . . . 0.0 109.911 172.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 p -163.21 144.47 9.57 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 178.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.54 158.61 33.44 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 169.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 ttpt -58.18 -42.01 85.13 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.894 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -167.26 -177.43 3.66 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 127.931 2.492 . . . . 0.0 107.546 172.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.6 p-90 -63.26 -33.18 74.95 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.891 1.071 . . . . 0.0 113.891 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.493 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.6 mt-30 -60.29 -49.75 76.38 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 120.558 1.526 . . . . 0.0 107.433 173.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -61.88 -34.06 75.34 Favored 'General case' 0 C--O 1.221 -0.396 0 O-C-N 121.588 -0.695 . . . . 0.0 111.378 176.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -68.23 -32.01 71.91 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.658 -0.651 . . . . 0.0 111.262 -178.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -46.4 82.84 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 171.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -56.51 -44.88 81.16 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.724 -0.61 . . . . 0.0 110.096 176.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -68.63 -13.92 62.68 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 121.216 -0.928 . . . . 0.0 113.083 174.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.5 m -82.96 -17.54 43.15 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 120.664 1.574 . . . . 0.0 111.592 169.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 3.3 mmt -130.35 -16.65 3.48 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -168.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.6 p -56.28 -37.02 48.33 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 120.173 1.351 . . . . 0.0 113.07 -169.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 19.2 m -68.33 -29.8 68.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.049 0.84 . . . . 0.0 111.645 -178.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 60.1 mt -75.91 -41.14 52.76 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 172.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.3 tp -58.46 -45.72 88.01 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 123.389 0.676 . . . . 0.0 110.568 179.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -60.15 -35.5 75.45 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.523 1.129 . . . . 0.0 112.118 -177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -96.54 17.25 16.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.738 -177.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.287 3.5 p30 43.06 38.17 1.39 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.941 1.696 . . . . 0.0 113.502 -176.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.438 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 24.3 m-85 -73.21 -18.05 61.29 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 168.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.9 pt -145.98 166.95 8.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 127.113 2.165 . . . . 0.0 108.522 179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.5 p -94.84 165.03 12.67 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.52 1.128 . . . . 0.0 109.24 169.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -59.99 -35.64 75.45 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.279 -0.888 . . . . 0.0 111.066 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.06 -21.33 66.37 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.205 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.9 t80 -62.0 -42.72 99.46 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 119.526 1.057 . . . . 0.0 110.0 175.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.9 mp -58.86 -50.3 79.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 123.45 0.7 . . . . 0.0 109.207 175.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 32.2 tp60 -70.36 -24.76 63.02 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 118.565 -0.731 . . . . 0.0 111.924 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.42 -42.86 92.83 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 119.406 1.003 . . . . 0.0 110.252 174.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 74.5 mt -66.95 -47.15 83.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.493 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 93.2 mttt -60.72 -37.78 82.88 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 118.998 -0.525 . . . . 0.0 111.012 -177.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.53 -46.94 88.32 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 119.003 0.82 . . . . 0.0 111.301 -179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 46.2 m -68.48 -29.85 68.56 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.578 -0.701 . . . . 0.0 111.405 174.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 37.8 m -62.76 -39.78 95.22 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.279 0.491 . . . . 0.0 110.172 174.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 89.9 mt -67.28 -48.63 77.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 119.008 0.822 . . . . 0.0 109.319 173.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -68.56 -33.78 74.68 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -169.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -147.19 -44.96 0.17 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.468 0.707 . . . . 0.0 111.859 -168.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 140.83 177.52 16.27 Favored Glycine 0 CA--C 1.53 1.029 0 CA-C-O 119.107 -0.83 . . . . 0.0 111.333 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -37.11 127.54 0.55 Allowed 'Trans proline' 0 N--CA 1.458 -0.596 1 C-N-CA 125.586 4.191 . . . . 0.0 114.674 176.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -51.72 -40.62 60.51 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.233 1.013 . . . . 0.0 113.248 174.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -144.4 134.67 24.34 Favored 'General case' 0 C--N 1.345 0.37 0 CA-C-N 118.987 0.812 . . . . 0.0 109.892 -177.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 32.1 mm -140.4 138.48 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 N-CA-C 104.744 -2.317 . . . . 0.0 104.744 177.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -123.27 -32.24 3.45 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.294 0.638 . . . . 0.0 111.692 -169.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.03 158.97 24.73 Favored Pre-proline 0 C--O 1.237 0.433 0 C-N-CA 126.927 2.091 . . . . 0.0 105.627 -175.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -60.0 117.04 3.74 Favored 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 121.505 1.47 . . . . 0.0 109.541 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 94.48 6.33 61.19 Favored Glycine 0 CA--C 1.528 0.906 0 CA-C-O 118.349 -1.25 . . . . 0.0 113.641 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.0 t -130.62 122.5 52.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 CA-C-N 119.477 1.639 . . . . 0.0 108.197 -171.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.9 167.52 14.55 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.575 1.55 . . . . 0.0 109.461 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.425 ' CE ' HD13 ' A' ' 118' ' ' LEU . 12.8 ttm -143.38 66.81 16.23 Favored Pre-proline 0 C--N 1.331 -0.219 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 175.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_exo -58.69 147.51 87.28 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 CA-C-O 122.472 0.947 . . . . 0.0 111.511 -173.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -179.54 155.02 0.65 Allowed 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 128.365 2.666 . . . . 0.0 105.444 -169.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -133.9 153.74 51.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 106.246 -1.761 . . . . 0.0 106.246 169.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -54.45 145.14 39.49 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-O 117.685 -1.15 . . . . 0.0 109.377 -177.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_exo -44.46 -44.91 13.21 Favored 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 123.818 3.012 . . . . 0.0 113.204 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -63.0 -14.51 48.7 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.617 1.567 . . . . 0.0 113.151 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 65.3 m -73.64 -25.24 60.19 Favored 'General case' 0 C--N 1.338 0.098 0 CA-C-N 118.613 0.642 . . . . 0.0 110.771 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 150.97 17.35 0.07 OUTLIER Glycine 0 C--N 1.337 0.609 0 CA-C-O 118.295 -1.28 . . . . 0.0 114.154 -178.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.22 152.54 44.94 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.142 1.471 . . . . 0.0 109.372 169.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.2 mt -131.65 -31.86 1.53 Allowed 'General case' 0 N--CA 1.462 0.145 0 C-N-CA 124.128 0.971 . . . . 0.0 110.724 -175.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.438 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 75.3 mttt -146.68 158.24 43.87 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 125.628 1.571 . . . . 0.0 108.496 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.3 m -92.15 122.84 35.03 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.086 0.554 . . . . 0.0 110.184 -178.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.07 -176.15 38.92 Favored Glycine 0 CA--C 1.532 1.117 0 C-N-CA 124.697 1.141 . . . . 0.0 111.02 -177.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 51.7 mtt -145.85 172.31 13.52 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.397 1.479 . . . . 0.0 110.64 -176.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 70.2 m -149.5 160.41 43.49 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.802 1.241 . . . . 0.0 109.06 169.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 26.4 tp -136.47 121.27 18.6 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 126.177 1.791 . . . . 0.0 108.892 -172.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.478 ' O ' HD22 ' A' ' 99' ' ' LEU . 91.5 m -137.63 129.76 29.09 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 -171.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.2 tp -122.89 139.1 54.4 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.8 mp -119.84 118.81 31.77 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 126.559 1.944 . . . . 0.0 106.433 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -60.12 -24.5 64.73 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.769 0.827 . . . . 0.0 113.007 -178.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -115.58 -9.28 12.04 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.63 1.172 . . . . 0.0 111.946 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 61.17 -176.98 4.51 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 123.734 0.683 . . . . 0.0 112.119 -169.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -149.6 160.62 5.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 169.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -105.32 108.33 19.78 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 121.519 0.676 . . . . 0.0 110.96 -169.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -74.9 135.28 74.24 Favored Pre-proline 0 N--CA 1.448 -0.532 0 C-N-CA 124.572 1.149 . . . . 0.0 108.396 170.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_endo -66.28 156.87 62.92 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.492 2.128 . . . . 0.0 110.474 176.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 70.65 24.4 76.93 Favored Glycine 0 CA--C 1.532 1.112 0 CA-C-O 119.602 -0.554 . . . . 0.0 113.451 173.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 42.5 t30 -136.86 164.72 27.64 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.292 1.437 . . . . 0.0 107.747 171.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -78.94 -25.44 43.62 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -172.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -147.33 164.74 21.5 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 123.214 0.606 . . . . 0.0 112.512 -169.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.2 144.62 26.65 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.12 2.547 . . . . 0.0 111.031 177.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 22.1 mm -87.13 131.9 33.87 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -178.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.9 mtpt -103.88 -25.76 12.93 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.97 169.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.478 HD22 ' O ' ' A' ' 82' ' ' THR . 3.0 tm? -134.06 132.27 39.81 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 120.655 1.57 . . . . 0.0 109.966 -174.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -131.24 126.76 36.33 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -174.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.0 mt -109.84 103.59 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 169.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -66.6 146.8 49.05 Favored Glycine 0 CA--C 1.53 0.982 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 169.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.457 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -143.0 138.07 29.76 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 104.907 -2.257 . . . . 0.0 104.907 169.568 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.457 ' N ' HD23 ' A' ' 103' ' ' LEU . 94.9 p -131.34 147.95 52.62 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 126.139 1.775 . . . . 0.0 106.762 168.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -147.33 135.35 21.37 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.26 -21.52 58.5 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 122.753 0.421 . . . . 0.0 111.81 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -144.66 155.8 43.78 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.02 0.928 . . . . 0.0 109.825 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.18 -35.42 75.34 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.0 -31.05 62.78 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 120.894 -1.128 . . . . 0.0 111.064 176.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 9.8 m -64.8 -38.34 90.64 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.926 -0.484 . . . . 0.0 110.33 170.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.6 t60 -59.31 -49.72 76.76 Favored 'General case' 0 C--N 1.342 0.247 0 C-N-CA 123.521 0.729 . . . . 0.0 109.662 171.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 17.2 mm -55.37 -52.61 44.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 N-CA-C 109.16 -0.681 . . . . 0.0 109.16 178.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.03 -39.72 96.07 Favored Glycine 0 CA--C 1.531 1.079 0 CA-C-N 119.098 0.863 . . . . 0.0 112.093 -177.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.85 -52.82 32.36 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.291 1.036 . . . . 0.0 110.635 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.9 mm -51.8 -47.86 39.35 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 C-N-CA 125.414 1.485 . . . . 0.0 108.571 174.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -67.45 -9.96 46.94 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 120.931 -1.106 . . . . 0.0 112.31 -177.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -91.46 -49.95 6.05 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 169.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.534 HD12 ' N ' ' A' ' 119' ' ' SER . 1.0 OUTLIER -70.77 -22.84 62.34 Favored 'General case' 0 CA--C 1.52 -0.19 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -173.456 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.534 ' N ' HD12 ' A' ' 118' ' ' LEU . 33.7 m -62.95 -25.68 68.47 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.673 0.789 . . . . 0.0 111.135 172.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -66.75 -22.89 66.04 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.582 -0.699 . . . . 0.0 109.427 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 32.1 mt -95.04 -71.92 0.65 Allowed 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.208 1.003 . . . . 0.0 110.621 177.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 22.5 mt -68.57 -16.47 63.87 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -169.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 32.1 m -97.28 27.75 4.02 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 120.176 1.353 . . . . 0.0 111.423 177.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -132.4 112.86 12.52 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.209 1.804 . . . . 0.0 106.388 173.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -61.89 -26.21 68.02 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.981 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -64.15 -42.87 96.59 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.006 0.523 . . . . 0.0 109.99 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.93 -43.21 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 123.689 0.796 . . . . 0.0 109.146 175.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 46.4 mt -55.02 -42.27 72.39 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 118.934 0.788 . . . . 0.0 111.095 -176.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -69.12 -36.5 77.56 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 118.579 -0.724 . . . . 0.0 111.015 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -65.21 -40.25 93.89 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 119.627 1.103 . . . . 0.0 108.951 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 24.6 mt -66.95 -52.6 40.97 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 176.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 54.9 mt -63.61 -9.0 11.42 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -177.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 61.1 p -122.7 10.48 9.66 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.688 1.195 . . . . 0.0 111.356 176.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -61.93 113.22 2.67 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 124.289 1.036 . . . . 0.0 109.72 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 21.5 m -74.63 -15.38 60.82 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.864 0.866 . . . . 0.0 112.212 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 85.8 p -153.05 163.09 40.48 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.894 0.854 . . . . 0.0 111.599 -173.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -58.04 -37.61 74.72 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.883 1.273 . . . . 0.0 109.494 169.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -60.67 -41.41 95.02 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 123.102 0.561 . . . . 0.0 110.945 175.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -65.38 -36.32 83.64 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 118.752 0.706 . . . . 0.0 112.138 176.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 36.4 mt -65.28 -46.93 78.47 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.641 1.11 . . . . 0.0 108.69 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.66 -32.97 67.83 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.921 0.888 . . . . 0.0 113.203 172.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -67.58 -40.52 84.84 Favored 'General case' 0 C--N 1.33 -0.243 0 O-C-N 121.103 -0.998 . . . . 0.0 110.412 177.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 71.1 mt -66.52 -36.76 78.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 123.777 0.831 . . . . 0.0 109.427 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.0 mm -58.61 -52.11 63.67 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 169.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 22.7 m -63.88 -27.78 69.39 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 122.259 0.224 . . . . 0.0 111.415 -173.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 10.1 ttt180 -60.09 -26.31 66.09 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 125.399 1.48 . . . . 0.0 113.104 174.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.867 0 N-CA-C 108.662 -1.775 . . . . 0.0 108.662 -178.643 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 tpp . . . . . 0 N--CA 1.488 1.446 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 39.4 mmm-85 -65.53 117.23 7.71 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 169.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.27 -44.92 94.91 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 177.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 6.3 p -56.36 -19.75 16.09 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.295 1.038 . . . . 0.0 113.187 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.25 -26.6 68.86 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.738 1.153 . . . . 0.0 112.338 174.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -96.87 -23.41 16.37 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 118.241 -0.885 . . . . 0.0 112.852 -172.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 25.5 m-85 -101.81 101.55 18.76 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 120.298 1.408 . . . . 0.0 107.331 -173.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -61.55 -64.44 0.08 OUTLIER 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 123.378 2.719 . . . . 0.0 115.164 -169.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.439 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.9 tp10 -158.94 -77.68 0.07 Allowed 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.74 0.816 . . . . 0.0 111.908 -172.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -69.23 10.86 0.27 Allowed 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.089 1.355 . . . . 0.0 111.502 177.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.439 ' H ' ' C ' ' A' ' 9' ' ' GLU . 1.8 p -79.27 12.09 2.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.149 2.18 . . . . 0.0 113.329 -169.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.7 mp -135.24 130.11 50.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.862 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 173.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.6 m -144.35 153.76 42.31 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.034 0.534 . . . . 0.0 110.866 175.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 74.1 t -122.81 142.23 40.14 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 106.182 -1.784 . . . . 0.0 106.182 170.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.4 mt -140.59 146.11 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 N-CA-C 107.216 -1.402 . . . . 0.0 107.216 -170.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 48.8 m-70 -65.42 -51.94 56.8 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 110.171 -0.307 . . . . 0.0 110.171 174.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -159.0 147.63 18.3 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 -178.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.497 ' HB3' HG21 ' A' ' 88' ' ' VAL . . . -76.06 149.84 37.42 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 171.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 tmmm? -58.2 -39.22 78.39 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.029 0.532 . . . . 0.0 109.788 177.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -161.67 175.93 11.5 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 126.465 1.906 . . . . 0.0 107.937 179.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -69.16 -33.69 73.8 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 123.364 0.665 . . . . 0.0 111.552 174.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.405 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 4.8 pt20 -61.18 -41.82 97.48 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 119.858 1.208 . . . . 0.0 108.884 169.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -67.44 -32.89 74.06 Favored 'General case' 0 C--O 1.223 -0.319 0 O-C-N 121.606 -0.684 . . . . 0.0 111.561 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -34.83 78.94 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 122.946 0.498 . . . . 0.0 110.005 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.34 -46.79 80.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 169.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -55.12 -47.23 75.33 Favored 'General case' 0 C--O 1.226 -0.171 0 C-N-CA 122.954 0.501 . . . . 0.0 110.047 -176.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -66.28 -31.37 72.13 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 117.994 -1.003 . . . . 0.0 112.441 174.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.8 m -61.87 -22.49 65.58 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.918 1.235 . . . . 0.0 112.032 172.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.2 mmt -123.06 -17.51 6.67 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 114.564 1.32 . . . . 0.0 114.564 -169.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.34 -36.51 52.94 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-N 120.619 1.554 . . . . 0.0 113.019 -169.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.6 m -67.31 -31.76 72.27 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.989 0.813 . . . . 0.0 110.932 -179.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 73.3 mt -73.49 -40.95 63.7 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 123.748 0.819 . . . . 0.0 109.106 173.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.0 tp -59.34 -44.61 92.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.455 0.702 . . . . 0.0 110.495 179.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -64.25 -42.51 96.48 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 124.222 1.009 . . . . 0.0 111.693 -176.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.3 13.7 3.39 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.98 1.312 . . . . 0.0 111.735 175.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.301 6.2 p30 44.51 37.47 2.13 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.68 1.992 . . . . 0.0 114.944 -176.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -69.9 -18.94 63.42 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.088 -1.008 . . . . 0.0 109.492 168.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 35.7 pt -145.86 168.33 7.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 126.736 2.014 . . . . 0.0 108.766 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 m -106.13 162.02 14.0 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.775 1.63 . . . . 0.0 108.695 169.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -58.78 -36.88 75.15 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.172 -0.955 . . . . 0.0 112.28 -174.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -59.99 -24.08 64.16 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.893 0.877 . . . . 0.0 113.007 175.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 67.1 t80 -63.74 -46.16 86.59 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 119.485 1.039 . . . . 0.0 110.264 175.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.3 mp -60.5 -47.92 90.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 177.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -66.94 -27.66 67.65 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 118.473 -0.775 . . . . 0.0 111.774 -175.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.35 74.33 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.323 0.965 . . . . 0.0 111.691 173.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 26.1 mt -76.12 -50.59 22.22 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 82.3 mttt -57.89 -44.68 86.86 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 -173.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -61.9 -50.69 71.2 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 123.377 0.671 . . . . 0.0 111.071 -172.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.5 m -66.2 -38.74 88.72 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 118.051 0.387 . . . . 0.0 110.744 178.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.1 m -56.25 -46.45 79.62 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.137 0.575 . . . . 0.0 111.012 174.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 73.5 mt -71.07 -42.22 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 123.243 0.617 . . . . 0.0 109.979 -178.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.0 m-80 -77.88 -33.66 51.91 Favored 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -169.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -23.25 1.65 Allowed 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -169.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.64 161.17 10.91 Favored Glycine 0 CA--C 1.529 0.961 0 C-N-CA 125.109 1.338 . . . . 0.0 110.18 179.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -64.04 153.33 76.65 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 122.219 1.946 . . . . 0.0 110.126 -179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -131.73 14.46 4.87 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -171.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -139.01 80.96 1.82 Allowed 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 125.073 1.349 . . . . 0.0 107.989 170.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.5 mm -124.29 136.64 59.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 105.869 -1.9 . . . . 0.0 105.869 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -122.25 -30.38 4.01 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.304 0.642 . . . . 0.0 111.666 -169.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.59 160.91 27.73 Favored Pre-proline 0 C--O 1.236 0.351 0 N-CA-C 107.122 -1.436 . . . . 0.0 107.122 178.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -57.08 113.51 1.51 Allowed 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 121.857 1.704 . . . . 0.0 108.959 169.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 104.22 -8.94 49.52 Favored Glycine 0 CA--C 1.531 1.088 0 CA-C-O 117.574 -1.681 . . . . 0.0 114.187 -178.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.2 t -129.48 125.1 61.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.415 0 CA-C-N 119.943 1.871 . . . . 0.0 109.831 -169.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -123.68 167.99 13.25 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 125.687 1.595 . . . . 0.0 109.684 175.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 1.6 ttm -141.86 62.27 14.22 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -49.58 142.3 24.41 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 122.417 2.078 . . . . 0.0 114.421 -175.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 9.8 t-80 179.93 153.7 0.51 Allowed 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 128.754 2.822 . . . . 0.0 106.256 -171.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.92 159.26 42.01 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 125.741 1.616 . . . . 0.0 107.609 169.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 32.1 mtp-105 -51.16 142.66 18.37 Favored Pre-proline 0 CA--C 1.535 0.394 0 CA-C-O 117.707 -1.139 . . . . 0.0 109.203 177.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_exo -45.53 -42.02 18.38 Favored 'Trans proline' 0 CA--C 1.538 0.685 0 C-N-CA 123.716 2.944 . . . . 0.0 113.091 -178.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -61.31 -14.48 27.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.429 1.492 . . . . 0.0 113.336 -177.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.9 m -77.76 -9.27 58.92 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.588 0.755 . . . . 0.0 112.011 -178.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 137.12 17.28 0.71 Allowed Glycine 0 CA--C 1.527 0.82 0 CA-C-O 118.195 -1.336 . . . . 0.0 113.868 178.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.97 149.38 47.82 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.801 1.8 . . . . 0.0 109.463 169.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.2 mt -129.43 -35.86 1.72 Allowed 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.781 1.233 . . . . 0.0 110.146 -176.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.6 mtmt -144.76 158.93 43.6 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.502 1.521 . . . . 0.0 108.49 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 76.1 m -90.97 127.25 36.34 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.147 0.579 . . . . 0.0 110.367 -178.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -170.98 -178.69 41.7 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.978 1.275 . . . . 0.0 110.836 -177.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 37.9 mtt -145.44 170.36 16.53 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 125.675 1.59 . . . . 0.0 110.713 -177.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 46.8 m -152.79 171.5 18.16 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.355 1.462 . . . . 0.0 109.245 169.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.9 tp -143.81 128.86 18.6 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 127.052 2.141 . . . . 0.0 107.895 -169.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 90.5 m -130.46 143.14 50.57 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.057 1.343 . . . . 0.0 107.554 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.2 tp -134.17 143.33 47.83 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 171.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -113.3 137.73 51.06 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 124.591 1.156 . . . . 0.0 108.724 176.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -69.36 -40.98 77.15 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 168.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 -118.92 96.35 5.21 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.964 2.106 . . . . 0.0 107.996 177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -50.85 156.96 2.51 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.002 1.286 . . . . 0.0 112.942 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.497 HG21 ' HB3' ' A' ' 18' ' ' ALA . 84.1 t -118.84 152.78 21.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 106.722 -1.584 . . . . 0.0 106.722 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -113.85 93.95 4.61 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 123.899 0.879 . . . . 0.0 110.458 -167.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -47.25 135.45 9.16 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.078 169.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -61.5 133.47 45.98 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 121.805 1.67 . . . . 0.0 110.393 -175.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 71.44 7.95 65.37 Favored Glycine 0 CA--C 1.533 1.203 0 CA-C-O 118.458 -1.19 . . . . 0.0 114.444 176.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -71.98 173.45 8.37 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.85 1.825 . . . . 0.0 111.131 174.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -65.55 -45.94 81.44 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 122.098 -0.376 . . . . 0.0 111.176 173.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -159.99 173.71 4.63 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 125.588 1.555 . . . . 0.0 112.344 -176.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -57.21 154.68 33.03 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.185 2.59 . . . . 0.0 113.391 173.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 39.9 mm -111.42 132.83 58.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -105.44 -15.4 15.03 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 117.347 -1.311 . . . . 0.0 110.973 173.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 46.4 tp -140.21 131.08 25.99 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-N 120.279 1.4 . . . . 0.0 109.979 -169.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.8 mp -137.53 138.87 40.1 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 -176.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 3.7 mt -118.03 119.88 62.81 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 169.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.21 148.47 32.88 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 108.964 -1.654 . . . . 0.0 108.964 169.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.413 HD12 HD21 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -143.13 136.79 28.59 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 104.402 -2.444 . . . . 0.0 104.402 169.445 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.0 p -129.95 147.48 51.71 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 106.43 -1.692 . . . . 0.0 106.43 169.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.3 136.35 23.56 Favored 'General case' 0 CA--C 1.514 -0.422 0 CA-C-N 118.911 0.778 . . . . 0.0 109.244 -176.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.19 -22.63 55.1 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.804 0.442 . . . . 0.0 111.87 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -145.66 155.86 43.28 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.826 0.85 . . . . 0.0 109.984 -178.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.18 -34.97 74.33 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -75.09 -31.92 61.33 Favored 'General case' 0 N--CA 1.466 0.356 0 O-C-N 120.84 -1.162 . . . . 0.0 111.01 177.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.5 m -63.55 -40.59 97.39 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 122.095 -0.378 . . . . 0.0 110.025 169.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -58.28 -48.75 79.49 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 123.753 0.821 . . . . 0.0 110.104 172.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 11.1 mm -56.21 -53.63 37.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 123.472 0.709 . . . . 0.0 109.345 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.9 -39.05 96.39 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 118.822 0.737 . . . . 0.0 111.691 -176.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.61 -52.51 44.45 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.343 1.057 . . . . 0.0 110.451 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.5 mm -53.05 -47.32 54.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 C-N-CA 125.322 1.449 . . . . 0.0 108.791 176.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -66.96 -16.29 64.25 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.735 -0.603 . . . . 0.0 111.858 -177.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -87.48 -46.38 9.65 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 123.695 0.798 . . . . 0.0 109.534 174.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.413 HD21 HD12 ' A' ' 103' ' ' LEU . 3.9 pp -71.17 -23.95 62.15 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.171 -178.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 63.0 m -59.5 -23.4 62.75 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 123.4 0.68 . . . . 0.0 112.11 172.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -64.62 -20.92 66.56 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.164 0.893 . . . . 0.0 110.25 173.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 31.0 mt -106.59 -60.71 1.63 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.631 1.572 . . . . 0.0 111.095 -178.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -59.24 -31.55 69.18 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.916 1.286 . . . . 0.0 113.622 -177.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 60.5 m -101.67 26.97 6.78 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 118.681 0.673 . . . . 0.0 110.832 -175.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -139.94 93.21 2.62 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -170.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.1 -27.0 41.83 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.949 0.9 . . . . 0.0 112.756 -174.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.95 -45.55 91.95 Favored 'General case' 0 C--N 1.339 0.129 0 C-N-CA 122.882 0.473 . . . . 0.0 110.034 176.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.5 mp -68.16 -45.34 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 C-N-CA 123.907 0.883 . . . . 0.0 108.817 175.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 73.0 mt -54.78 -42.69 72.06 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 118.753 -0.642 . . . . 0.0 111.291 -174.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -67.05 -40.87 87.19 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 118.407 0.549 . . . . 0.0 110.601 178.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -69.19 -33.99 74.23 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 118.71 0.687 . . . . 0.0 110.124 -176.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 23.4 mt -69.74 -53.37 18.72 Favored 'General case' 0 C--O 1.224 -0.239 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 170.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 31.4 mt -57.41 -21.05 33.92 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -176.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 82.6 p -114.21 8.53 16.88 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.539 1.136 . . . . 0.0 111.181 -177.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.92 125.32 22.56 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.206 1.002 . . . . 0.0 110.244 178.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.9 m -85.27 -10.1 56.9 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.119 0.968 . . . . 0.0 111.683 177.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 71.9 p -154.4 159.19 40.97 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 118.903 0.774 . . . . 0.0 110.451 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -59.16 -33.51 71.01 Favored 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.175 0.59 . . . . 0.0 109.644 169.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -57.75 -39.27 76.96 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 118.967 -0.539 . . . . 0.0 111.236 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -66.32 -44.4 83.48 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.806 0.73 . . . . 0.0 111.671 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.1 mt -63.02 -50.28 71.3 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.769 0.713 . . . . 0.0 109.135 178.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.01 -32.6 66.31 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 124.912 1.285 . . . . 0.0 113.381 173.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.12 -43.26 82.87 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 119.877 1.217 . . . . 0.0 110.054 176.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 88.9 mt -64.91 -36.43 77.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 C-N-CA 123.732 0.813 . . . . 0.0 109.587 178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 29.8 mm -58.51 -52.28 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 169.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 33.8 m -66.77 -26.41 66.95 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.754 0.422 . . . . 0.0 111.385 -171.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 8.1 ttm180 -57.69 -28.85 64.18 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.868 1.667 . . . . 0.0 113.001 173.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.933 0 N-CA-C 109.002 -1.639 . . . . 0.0 109.002 -174.765 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 tpt . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 110.086 -0.338 . . . . 0.0 110.086 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -66.79 109.21 2.8 Favored 'General case' 0 C--N 1.339 0.133 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 169.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -52.24 -42.08 63.32 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.211 0.604 . . . . 0.0 110.05 178.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.61 -22.47 13.55 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.853 1.661 . . . . 0.0 113.485 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -65.71 -26.85 67.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.153 0.888 . . . . 0.0 112.094 177.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -96.71 -19.08 19.23 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.189 -170.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -97.7 112.72 62.22 Favored Pre-proline 0 CA--C 1.546 0.809 0 CA-C-N 120.864 1.665 . . . . 0.0 108.75 -173.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -60.69 -173.22 0.09 OUTLIER 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 125.236 3.957 . . . . 0.0 114.711 175.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -72.99 145.61 46.58 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.323 -0.992 . . . . 0.0 108.323 171.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 46.1 m 50.08 24.36 1.38 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.359 1.464 . . . . 0.0 112.428 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 37.0 p -74.49 -9.04 58.2 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.444 -0.785 . . . . 0.0 112.357 -172.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.4 mp -115.49 136.94 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.927 0 C-N-CA 126.634 1.973 . . . . 0.0 107.048 -170.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.7 m -144.76 156.22 43.94 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.714 1.206 . . . . 0.0 110.335 -177.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.6 t -129.66 144.55 37.75 Favored 'Isoleucine or valine' 0 C--O 1.234 0.238 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 174.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mt -143.29 150.09 17.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 126.294 1.838 . . . . 0.0 106.539 -170.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 72.8 t60 -74.93 -48.2 25.8 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.565 -0.709 . . . . 0.0 109.883 171.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -159.95 144.19 14.6 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 107.184 -1.413 . . . . 0.0 107.184 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.17 162.12 24.87 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 169.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.3 tppt? -59.37 -43.75 92.83 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.033 0.533 . . . . 0.0 110.554 178.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -167.17 -178.1 3.98 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 127.679 2.392 . . . . 0.0 107.758 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 63.5 p-90 -64.3 -32.7 74.41 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.498 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.4 mt-30 -59.31 -52.7 64.52 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.706 1.594 . . . . 0.0 107.381 172.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -60.05 -36.55 77.56 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 121.803 -0.56 . . . . 0.0 111.295 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.61 -30.14 71.16 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-O 118.833 -0.603 . . . . 0.0 111.09 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -69.09 -47.7 73.47 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 CA-C-N 119.292 0.951 . . . . 0.0 108.548 172.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -55.68 -47.74 76.26 Favored 'General case' 0 C--O 1.227 -0.098 0 CA-C-N 118.315 0.507 . . . . 0.0 109.883 178.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -61.41 -33.59 73.96 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 117.928 -1.034 . . . . 0.0 111.974 174.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.1 m -64.83 -29.97 70.95 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 119.987 1.267 . . . . 0.0 112.428 175.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.6 mmm -115.95 -13.98 11.27 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -168.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -58.58 -33.85 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 120.299 1.409 . . . . 0.0 112.514 -169.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.7 p -65.78 -37.62 86.8 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.327 0.967 . . . . 0.0 110.652 179.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 77.7 mt -72.17 -37.81 69.26 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 123.587 0.755 . . . . 0.0 109.268 175.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 50.2 tp -60.47 -44.23 96.1 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.685 0.675 . . . . 0.0 110.306 177.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -63.89 -45.09 90.91 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 124.878 1.271 . . . . 0.0 111.827 -176.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -80.44 12.52 2.96 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.282 1.033 . . . . 0.0 111.595 175.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.33 4.6 p30 43.54 43.21 4.46 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.821 2.049 . . . . 0.0 114.891 -176.263 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.412 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 35.9 m-85 -75.96 -17.15 59.84 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 167.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.5 pt -145.26 173.82 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.653 1.981 . . . . 0.0 109.271 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 37.6 m -114.66 163.03 16.0 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.164 1.786 . . . . 0.0 109.267 169.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -61.21 -32.82 72.59 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.308 -0.87 . . . . 0.0 113.047 -170.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -58.23 -30.89 66.87 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.83 -0.544 . . . . 0.0 111.729 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -59.06 -46.59 87.86 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.391 0.676 . . . . 0.0 110.38 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.8 mp -56.73 -48.37 81.03 Favored 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 123.612 0.765 . . . . 0.0 109.001 176.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.5 tp60 -69.29 -26.24 64.64 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 118.264 -0.874 . . . . 0.0 112.027 -176.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.2 -39.37 93.84 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 119.828 1.195 . . . . 0.0 111.508 173.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 53.3 mt -66.5 -46.42 86.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.498 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.5 mttt -62.09 -42.4 99.18 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -178.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -64.18 -38.61 91.68 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 124.009 0.924 . . . . 0.0 111.407 179.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 m -62.93 -40.54 97.92 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.815 -0.553 . . . . 0.0 110.187 172.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 26.1 m -61.44 -38.52 87.47 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.762 0.825 . . . . 0.0 111.17 174.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 96.5 mt -64.42 -44.9 97.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-N 119.92 1.236 . . . . 0.0 109.817 173.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -65.23 -37.71 88.11 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -169.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -142.53 -9.56 0.83 Allowed 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 -168.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.48 178.42 32.61 Favored Glycine 0 CA--C 1.532 1.114 0 N-CA-C 107.711 -2.156 . . . . 0.0 107.711 -168.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -59.72 140.35 93.02 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 121.782 1.655 . . . . 0.0 109.384 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -126.48 10.46 7.29 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -169.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -134.78 88.1 2.4 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 169.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.4 mm -135.67 131.96 50.98 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 105.181 -2.155 . . . . 0.0 105.181 -173.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -124.55 -24.41 4.21 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 123.805 0.691 . . . . 0.0 110.918 -172.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.53 165.28 19.07 Favored Pre-proline 0 CA--C 1.537 0.478 0 C-N-CA 124.689 1.196 . . . . 0.0 108.112 170.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -49.35 126.94 16.79 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 122.338 2.025 . . . . 0.0 110.062 169.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 77.39 1.82 77.19 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-O 117.88 -1.511 . . . . 0.0 115.48 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 77.8 t -131.01 117.31 37.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.488 0 CA-C-N 120.322 2.061 . . . . 0.0 108.355 -173.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -119.17 163.57 16.87 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 125.687 1.595 . . . . 0.0 109.917 -177.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 5.7 ttm -134.14 60.68 46.1 Favored Pre-proline 0 CA--C 1.545 0.751 0 CA-C-O 118.998 -0.525 . . . . 0.0 112.096 176.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -54.06 147.82 42.03 Favored 'Trans proline' 0 CA--C 1.539 0.774 0 C-N-CA 122.345 2.03 . . . . 0.0 113.293 -172.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 175.6 157.52 0.21 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 128.726 2.811 . . . . 0.0 106.542 -168.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.39 159.12 42.85 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 126.137 1.775 . . . . 0.0 107.931 169.399 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -51.21 143.34 17.52 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-O 118.3 -0.857 . . . . 0.0 109.322 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -47.91 -42.07 31.81 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.079 2.519 . . . . 0.0 113.017 -176.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -62.22 -13.34 26.9 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.873 1.269 . . . . 0.0 114.05 -177.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 72.2 m -77.39 -6.12 52.21 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.636 0.774 . . . . 0.0 111.897 178.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 132.91 18.03 1.12 Allowed Glycine 0 CA--C 1.524 0.655 0 CA-C-O 118.206 -1.33 . . . . 0.0 113.315 175.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.45 148.13 49.99 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.792 1.796 . . . . 0.0 108.986 169.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.6 mt -127.66 -35.19 2.14 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 124.827 1.251 . . . . 0.0 110.501 -175.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.412 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 52.8 mttp -142.4 158.83 43.28 Favored 'General case' 0 C--O 1.233 0.213 0 C-N-CA 125.707 1.603 . . . . 0.0 107.916 -179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.1 m -91.15 125.17 35.85 Favored 'General case' 0 N--CA 1.442 -0.846 0 C-N-CA 123.157 0.583 . . . . 0.0 109.709 178.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -171.94 179.79 43.38 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 124.672 1.13 . . . . 0.0 110.966 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.627 ' SD ' HD21 ' A' ' 118' ' ' LEU . 56.7 mtt -143.23 167.95 20.92 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 125.453 1.501 . . . . 0.0 110.154 -172.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.4 p -148.57 167.53 25.16 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.926 1.291 . . . . 0.0 108.346 179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.486 HD22 HD11 ' A' ' 144' ' ' ILE . 5.1 tp -142.75 124.71 15.22 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.609 -0.682 . . . . 0.0 109.77 -176.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 64.9 m -131.77 133.49 44.81 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.5 tp -126.44 139.11 53.5 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 173.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.3 mp -119.31 123.27 43.81 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 105.296 -2.112 . . . . 0.0 105.296 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -60.1 -41.26 92.18 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.666 0.667 . . . . 0.0 111.532 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 36.2 mm-40 -90.69 -16.7 28.07 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.383 1.073 . . . . 0.0 111.724 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.21 178.86 9.1 Favored Glycine 0 CA--C 1.534 1.272 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 -168.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.07 156.88 15.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 N-CA-C 105.898 -1.89 . . . . 0.0 105.898 168.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -102.87 99.29 9.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.908 0.861 . . . . 0.0 112.189 -168.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -67.29 142.24 96.6 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 114.332 -1.304 . . . . 0.0 108.484 169.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -75.49 69.02 6.03 Favored 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 124.082 3.188 . . . . 0.0 113.241 -169.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 165.3 -11.3 0.07 OUTLIER Glycine 0 CA--C 1.531 1.088 0 CA-C-O 118.336 -1.258 . . . . 0.0 116.015 169.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -70.36 169.57 13.63 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 119.776 1.788 . . . . 0.0 110.48 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -69.12 -32.42 71.8 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.45 -0.782 . . . . 0.0 111.705 170.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.87 168.73 10.42 Favored Pre-proline 0 CA--C 1.544 0.74 0 C-N-CA 124.546 1.138 . . . . 0.0 112.153 -175.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -51.26 131.25 35.25 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.368 2.712 . . . . 0.0 112.116 174.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 27.9 mm -69.47 111.41 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 107.298 -1.371 . . . . 0.0 107.298 175.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -82.94 -29.53 29.05 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 116.743 -1.599 . . . . 0.0 110.409 169.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 9.8 tp -132.68 139.94 47.9 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 121.174 1.806 . . . . 0.0 112.126 -173.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.0 mp -134.6 103.27 5.6 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 -178.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.654 HG21 HD22 ' A' ' 118' ' ' LEU . 0.6 OUTLIER -83.17 118.1 30.21 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.142 0 N-CA-C 104.442 -2.429 . . . . 0.0 104.442 169.258 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -84.35 150.81 26.23 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 109.921 -1.272 . . . . 0.0 109.921 172.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.405 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -142.9 142.86 31.83 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 104.921 -2.251 . . . . 0.0 104.921 169.839 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.405 ' N ' HD23 ' A' ' 103' ' ' LEU . 16.3 m -142.85 143.52 32.13 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 169.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -143.46 139.08 29.7 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 -169.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.39 -23.26 43.39 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.153 0.581 . . . . 0.0 111.92 -176.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -145.48 156.63 43.85 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.172 0.989 . . . . 0.0 109.809 -178.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.77 -34.75 73.4 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.178 0.806 . . . . 0.0 113.178 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -75.78 -32.34 59.86 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 120.936 -1.103 . . . . 0.0 111.062 177.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.2 m -62.32 -42.01 99.01 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 169.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 35.5 t60 -57.92 -49.09 77.94 Favored 'General case' 0 C--N 1.341 0.212 0 C-N-CA 124.034 0.933 . . . . 0.0 110.211 173.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 8.9 mm -56.21 -54.77 23.73 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 118.869 0.759 . . . . 0.0 109.444 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.24 -38.48 94.61 Favored Glycine 0 CA--C 1.531 1.035 0 CA-C-N 118.664 0.666 . . . . 0.0 111.71 -176.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.78 -49.48 58.31 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 124.493 1.117 . . . . 0.0 110.816 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.9 mm -55.94 -43.05 73.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 124.448 1.099 . . . . 0.0 108.989 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.3 mm-40 -70.49 -12.88 61.86 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.461 0.704 . . . . 0.0 112.061 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.26 -43.67 14.62 Favored 'General case' 0 N--CA 1.441 -0.876 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 170.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.654 HD22 HG21 ' A' ' 101' ' ' ILE . 96.3 mt -70.06 -27.71 64.86 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 121.864 -0.523 . . . . 0.0 111.759 -176.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 27.9 m -57.65 -21.87 42.39 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 171.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -74.89 -22.46 58.63 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.556 1.071 . . . . 0.0 111.058 175.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 49.2 mt -101.98 -62.22 1.29 Allowed 'General case' 0 N--CA 1.464 0.232 0 C-N-CA 123.872 0.869 . . . . 0.0 110.639 -177.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.37 -13.24 58.16 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.402 1.481 . . . . 0.0 113.62 -173.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 37.3 m -117.81 29.86 7.59 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 119.039 0.836 . . . . 0.0 110.511 179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -131.98 107.99 9.05 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 123.841 0.856 . . . . 0.0 109.035 175.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -55.96 -34.58 65.83 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.721 1.208 . . . . 0.0 110.454 -176.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -61.79 -44.84 96.08 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.242 179.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.35 -44.05 77.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 124.372 1.069 . . . . 0.0 109.351 177.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 7.0 mp -50.52 -45.24 56.56 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 119.123 0.874 . . . . 0.0 111.506 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -68.73 -37.09 79.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 118.829 0.74 . . . . 0.0 110.698 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -64.69 -40.49 95.48 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 118.969 0.804 . . . . 0.0 108.913 179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 7.3 mt -69.12 -53.38 20.5 Favored 'General case' 0 CA--C 1.52 -0.184 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 178.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 61.0 mt -61.44 -11.85 12.23 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.232 1.013 . . . . 0.0 113.575 -174.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 70.8 p -121.87 5.83 9.91 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.593 1.157 . . . . 0.0 111.661 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.63 119.58 7.86 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 124.58 1.152 . . . . 0.0 110.539 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -76.59 -15.6 59.8 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.186 0.994 . . . . 0.0 112.345 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.4 p -153.41 163.44 39.92 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 119.077 0.853 . . . . 0.0 111.502 -172.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 51.6 mp0 -59.09 -35.86 74.11 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.011 0.924 . . . . 0.0 109.18 169.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 41.2 mtmt -59.15 -47.08 86.62 Favored 'General case' 0 C--N 1.34 0.191 0 C-N-CA 122.855 0.462 . . . . 0.0 110.96 175.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -65.57 -34.14 77.56 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 112.319 0.488 . . . . 0.0 112.319 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.4 mt -66.34 -46.38 77.0 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.398 0.999 . . . . 0.0 109.276 174.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.11 -31.99 73.26 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.423 0.689 . . . . 0.0 112.445 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -58.59 -36.51 74.09 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.914 -1.116 . . . . 0.0 110.987 175.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 68.2 mt -71.74 -36.47 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 C-N-CA 124.083 0.953 . . . . 0.0 109.932 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . 0.486 HD11 HD22 ' A' ' 81' ' ' LEU . 50.7 mm -52.88 -52.5 27.82 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.472 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 24.8 m -69.23 -29.15 67.03 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.215 -171.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 14.0 ttm105 -70.07 -37.11 75.39 Favored 'General case' 0 N--CA 1.441 -0.88 0 C-N-CA 125.375 1.47 . . . . 0.0 110.628 177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.166 -1.352 . . . . 0.0 111.229 177.971 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpp? . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -68.06 112.38 5.0 Favored 'General case' 0 C--N 1.341 0.225 0 N-CA-C 104.281 -2.488 . . . . 0.0 104.281 168.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -53.41 -39.01 63.98 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.321 0.648 . . . . 0.0 110.368 -175.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.7 p -53.4 -19.74 3.82 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.972 1.709 . . . . 0.0 114.066 179.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -60.86 -23.45 65.15 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.924 1.238 . . . . 0.0 112.706 175.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.61 -14.71 15.53 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 -170.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -102.27 109.58 60.63 Favored Pre-proline 0 CA--C 1.539 0.543 0 CA-C-N 120.465 1.484 . . . . 0.0 108.079 -173.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -62.05 -70.53 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.042 2.495 . . . . 0.0 113.664 -173.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -163.15 -71.9 0.04 OUTLIER 'General case' 0 CA--C 1.522 -0.107 0 C-N-CA 123.936 0.894 . . . . 0.0 111.637 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 m -69.86 6.4 1.21 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.69 1.196 . . . . 0.0 111.912 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -71.31 -6.12 37.55 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.856 1.662 . . . . 0.0 113.593 -169.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 10.8 mt -122.75 130.14 74.69 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.787 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 -169.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.9 p -155.71 151.06 26.9 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.642 0.734 . . . . 0.0 111.914 -176.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.9 t -121.14 141.29 42.27 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 170.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.6 mt -136.58 145.99 29.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 C-N-CA 125.142 1.377 . . . . 0.0 108.214 -169.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -71.36 -38.43 71.58 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.807 -0.558 . . . . 0.0 111.699 175.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.9 p -174.33 148.15 1.23 Allowed 'General case' 0 C--O 1.237 0.403 0 N-CA-C 105.393 -2.077 . . . . 0.0 105.393 -178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.12 150.45 35.61 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 170.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.71 -41.55 81.98 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 176.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -157.61 169.65 24.19 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 126.78 2.032 . . . . 0.0 106.667 171.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -53.78 -34.7 59.91 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.322 1.449 . . . . 0.0 112.718 169.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.465 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 26.2 mt-30 -60.64 -48.44 81.76 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 119.68 1.127 . . . . 0.0 109.383 170.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -63.5 -32.29 73.7 Favored 'General case' 0 C--O 1.223 -0.34 0 O-C-N 121.771 -0.581 . . . . 0.0 111.263 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.1 -36.29 83.09 Favored 'General case' 0 N--CA 1.448 -0.525 0 O-C-N 121.833 -0.542 . . . . 0.0 110.059 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.99 -46.63 78.56 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 172.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -54.87 -45.85 74.67 Favored 'General case' 0 N--CA 1.463 0.215 0 O-C-N 121.751 -0.593 . . . . 0.0 110.697 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -65.32 -31.83 73.16 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 118.299 -0.858 . . . . 0.0 112.034 174.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.2 m -65.21 -20.3 66.37 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 119.618 1.099 . . . . 0.0 112.348 172.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.6 mmt -125.91 -20.02 4.7 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 114.919 1.452 . . . . 0.0 114.919 -168.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -60.03 -37.07 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.309 0 CA-C-N 120.714 1.597 . . . . 0.0 111.727 -169.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 10.3 m -65.39 -19.28 65.88 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.694 -0.629 . . . . 0.0 112.283 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 90.5 mt -91.36 -41.57 10.83 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 124.761 1.225 . . . . 0.0 109.144 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.6 tp -54.93 -42.68 72.55 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.007 0.923 . . . . 0.0 110.491 176.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -66.27 -28.33 68.63 Favored 'General case' 0 C--N 1.334 -0.108 0 C-N-CA 125.312 1.445 . . . . 0.0 113.108 -173.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.2 mmtt -99.54 18.52 17.71 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 118.241 0.473 . . . . 0.0 110.611 174.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.304 6.3 p30 46.72 38.43 5.81 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.539 1.536 . . . . 0.0 114.395 -171.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -68.42 -22.59 64.6 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.822 -1.174 . . . . 0.0 109.557 168.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.6 pt -143.43 177.24 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 126.446 1.898 . . . . 0.0 109.047 -176.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.8 m -117.16 157.46 25.91 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.603 1.961 . . . . 0.0 108.062 175.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.35 -31.79 70.65 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.026 -1.047 . . . . 0.0 112.94 -172.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -58.21 -33.24 69.08 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 121.887 -0.508 . . . . 0.0 111.878 175.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -60.09 -44.47 94.78 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 123.459 0.704 . . . . 0.0 110.494 -176.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -58.2 -50.94 76.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 174.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.0 tp60 -68.89 -26.17 64.98 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-O 118.412 -0.804 . . . . 0.0 112.058 -174.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.55 -43.64 89.39 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 119.493 1.042 . . . . 0.0 110.508 173.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 43.1 mt -68.3 -49.22 68.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.4 mttt -57.86 -42.51 84.63 Favored 'General case' 0 C--N 1.341 0.234 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 -176.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -61.35 -51.36 69.14 Favored 'General case' 0 C--O 1.231 0.097 0 C-N-CA 123.69 0.796 . . . . 0.0 111.242 -173.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 41.4 m -64.98 -39.9 94.16 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 118.306 0.503 . . . . 0.0 110.552 176.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 88.3 m -55.74 -41.35 73.79 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 122.964 0.506 . . . . 0.0 111.388 176.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 78.9 mt -76.16 -49.01 26.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 118.872 0.76 . . . . 0.0 109.993 179.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -72.45 -32.3 66.16 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -169.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -127.36 -46.42 1.48 Allowed 'General case' 0 C--O 1.231 0.113 0 C-N-CA 123.826 0.85 . . . . 0.0 110.642 -169.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 139.61 163.42 9.5 Favored Glycine 0 CA--C 1.53 0.972 0 N-CA-C 108.448 -1.861 . . . . 0.0 108.448 -176.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -62.55 149.17 91.94 Favored 'Trans proline' 0 N--CA 1.456 -0.721 0 C-N-CA 121.75 1.633 . . . . 0.0 109.149 176.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 25.1 p90 -131.72 10.93 4.76 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.088 0.773 . . . . 0.0 113.088 -169.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -133.6 87.64 2.4 Favored 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 169.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 39.3 mm -136.22 136.01 49.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 N-CA-C 104.919 -2.252 . . . . 0.0 104.919 -174.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -122.89 -30.65 3.78 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 123.215 0.606 . . . . 0.0 110.893 -170.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.57 157.94 27.08 Favored Pre-proline 0 N--CA 1.452 -0.343 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 173.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -51.99 120.02 6.56 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.026 1.818 . . . . 0.0 109.139 169.527 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 102.81 -15.68 55.31 Favored Glycine 0 CA--C 1.533 1.185 0 CA-C-O 117.942 -1.477 . . . . 0.0 114.117 -178.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 98.0 t -129.11 119.52 49.31 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-N 119.769 1.785 . . . . 0.0 109.538 -169.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -116.49 166.85 11.61 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 125.689 1.596 . . . . 0.0 109.385 173.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 13.5 ttm -137.37 60.68 28.11 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-O 118.641 -0.695 . . . . 0.0 111.667 175.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_exo -49.7 137.13 34.36 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 122.277 1.985 . . . . 0.0 113.98 -172.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -177.63 153.12 0.85 Allowed 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 128.45 2.7 . . . . 0.0 106.706 -169.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -134.35 161.07 36.01 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 126.392 1.877 . . . . 0.0 107.459 171.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -53.63 143.14 39.68 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-O 117.651 -1.166 . . . . 0.0 108.876 178.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_exo -46.83 -41.28 25.22 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.643 2.895 . . . . 0.0 113.246 -177.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -58.68 -14.72 9.17 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.601 1.56 . . . . 0.0 114.134 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 61.8 m -77.9 -4.61 47.62 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.66 0.784 . . . . 0.0 111.663 178.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 131.48 14.36 1.75 Allowed Glycine 0 C--N 1.337 0.597 0 CA-C-O 118.039 -1.423 . . . . 0.0 113.244 172.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.18 145.01 56.29 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 119.693 1.747 . . . . 0.0 109.289 169.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.5 mt -128.48 -34.82 2.0 Allowed 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.937 1.295 . . . . 0.0 110.291 -173.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -142.47 163.85 31.71 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 126.111 1.764 . . . . 0.0 108.026 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.1 m -97.49 130.79 44.54 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 123.187 0.595 . . . . 0.0 110.507 -176.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -173.74 179.48 45.09 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.742 1.163 . . . . 0.0 111.211 -176.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.633 ' SD ' HD21 ' A' ' 118' ' ' LEU . 56.4 mtt -144.89 167.85 21.64 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.168 1.387 . . . . 0.0 112.059 -172.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.3 m -138.33 166.16 24.91 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.076 1.75 . . . . 0.0 108.918 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.55 HD22 HD11 ' A' ' 144' ' ' ILE . 49.8 tp -147.85 85.47 1.55 Allowed 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.767 1.627 . . . . 0.0 108.025 -171.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 12.1 m -104.62 135.11 46.64 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.429 HD13 HD13 ' A' ' 99' ' ' LEU . 14.1 tp -129.58 142.62 50.71 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 173.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.6 mp -122.4 132.72 54.5 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 125.784 1.634 . . . . 0.0 106.795 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -66.0 -48.14 72.17 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 123.135 0.574 . . . . 0.0 110.237 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -90.43 -13.76 34.25 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.742 0.817 . . . . 0.0 112.317 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 64.31 -176.44 10.18 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 110.691 -0.963 . . . . 0.0 110.691 -168.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -148.53 167.8 3.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 169.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -120.3 96.6 5.21 Favored 'General case' 0 C--N 1.334 -0.079 0 O-C-N 121.643 -0.661 . . . . 0.0 110.699 -169.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -53.14 136.01 49.18 Favored Pre-proline 0 CA--C 1.538 0.487 0 CA-C-O 118.739 -0.648 . . . . 0.0 109.626 169.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -62.12 129.79 28.41 Favored 'Trans proline' 0 N--CA 1.455 -0.782 0 C-N-CA 122.057 1.838 . . . . 0.0 110.715 -173.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 70.65 9.58 65.61 Favored Glycine 0 CA--C 1.532 1.126 0 CA-C-O 118.365 -1.242 . . . . 0.0 114.562 174.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -72.42 168.83 17.63 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.901 1.851 . . . . 0.0 110.736 174.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.26 -38.1 89.27 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.397 0.517 . . . . 0.0 112.397 179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.03 163.29 24.45 Favored Pre-proline 0 CA--C 1.543 0.675 0 C-N-CA 125.545 1.538 . . . . 0.0 109.299 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -60.33 158.43 31.14 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 122.469 2.113 . . . . 0.0 112.25 173.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 36.3 mm -111.04 136.34 47.4 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 -177.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -108.74 -14.42 14.6 Favored 'General case' 0 C--O 1.224 -0.289 0 CA-C-O 117.118 -1.42 . . . . 0.0 110.988 173.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.429 HD13 HD13 ' A' ' 83' ' ' LEU . 14.1 tp -139.3 136.25 34.67 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 120.854 1.661 . . . . 0.0 110.787 -175.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.6 mp -139.1 95.5 2.95 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 -172.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.665 HG21 HD22 ' A' ' 118' ' ' LEU . 1.7 mp -76.69 118.7 23.64 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 106.326 -1.731 . . . . 0.0 106.326 169.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -77.95 150.11 35.41 Favored Glycine 0 CA--C 1.528 0.876 0 N-CA-C 109.423 -1.471 . . . . 0.0 109.423 170.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.432 HD23 ' N ' ' A' ' 104' ' ' SER . 0.3 OUTLIER -146.41 139.03 25.28 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 104.422 -2.436 . . . . 0.0 104.422 169.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.432 ' N ' HD23 ' A' ' 103' ' ' LEU . 4.0 m -142.5 144.93 33.2 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 106.104 -1.813 . . . . 0.0 106.104 169.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.16 138.96 25.57 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 -170.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -78.9 -23.28 44.88 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 122.818 0.447 . . . . 0.0 111.982 -175.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -143.68 155.51 44.25 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.838 0.855 . . . . 0.0 109.825 -176.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.93 -35.66 73.47 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.648 0.779 . . . . 0.0 113.013 -177.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -76.14 -32.32 59.05 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.059 -1.026 . . . . 0.0 111.173 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.9 m -62.31 -41.57 98.63 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 169.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -57.88 -50.03 74.7 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.229 1.011 . . . . 0.0 110.056 172.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.0 mm -56.16 -54.34 28.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 118.709 0.686 . . . . 0.0 109.412 179.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.41 -39.4 96.18 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-N 118.775 0.716 . . . . 0.0 111.561 -176.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.54 -49.62 62.45 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.183 0.993 . . . . 0.0 110.819 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.5 mm -55.63 -44.01 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.548 1.139 . . . . 0.0 108.974 176.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 90.4 mm-40 -70.72 -12.39 61.53 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.54 0.736 . . . . 0.0 112.032 -178.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.51 -45.21 13.83 Favored 'General case' 0 N--CA 1.441 -0.881 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 170.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.665 HD22 HG21 ' A' ' 101' ' ' ILE . 94.7 mt -69.84 -28.64 65.85 Favored 'General case' 0 CA--C 1.515 -0.371 0 O-C-N 121.919 -0.488 . . . . 0.0 111.732 -176.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.0 m -60.91 -20.76 62.57 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.241 0.616 . . . . 0.0 112.33 171.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -71.6 -22.57 61.7 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 119.672 1.124 . . . . 0.0 110.4 174.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 45.4 mt -103.3 -64.67 1.06 Allowed 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.157 0.983 . . . . 0.0 110.284 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.402 HD11 ' HB ' ' A' ' 101' ' ' ILE . 19.2 mt -73.46 1.21 10.29 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -170.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.0 m -121.73 27.78 7.99 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.118 0.967 . . . . 0.0 110.954 174.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -139.4 95.96 3.02 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 -170.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.2 -25.53 33.51 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.131 0.972 . . . . 0.0 112.618 -172.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -63.51 -44.18 95.05 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 123.064 0.546 . . . . 0.0 110.076 175.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -74.3 -40.82 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 C-N-CA 125.087 1.355 . . . . 0.0 109.887 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 6.8 mp -51.41 -43.39 61.95 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 119.712 1.142 . . . . 0.0 111.678 -178.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -69.93 -36.81 75.61 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 118.92 -0.562 . . . . 0.0 110.75 179.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -63.76 -41.55 97.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 119.107 0.867 . . . . 0.0 108.831 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 6.8 mt -67.17 -52.93 35.34 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 177.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 60.9 mt -62.38 -14.68 42.69 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -175.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 63.5 p -116.87 5.48 12.99 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.391 1.076 . . . . 0.0 111.83 178.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.38 115.74 3.46 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.14 0.976 . . . . 0.0 109.37 177.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 49.5 m -87.96 -4.79 58.78 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.206 1.002 . . . . 0.0 111.933 -177.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 80.6 p -152.84 163.08 40.42 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 123.547 0.739 . . . . 0.0 110.08 178.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 58.8 mp0 -58.32 -37.64 75.52 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 123.943 0.897 . . . . 0.0 109.819 169.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -58.05 -45.97 86.17 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-O 119.359 -0.353 . . . . 0.0 110.356 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -65.38 -26.55 68.05 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 118.608 -0.71 . . . . 0.0 112.905 177.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 49.5 mt -72.69 -48.29 40.19 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 120.305 1.412 . . . . 0.0 109.0 172.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.09 -26.84 69.02 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 177.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -58.73 -37.97 77.34 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.007 -1.058 . . . . 0.0 110.607 172.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 67.6 mt -74.29 -36.26 42.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 C-N-CA 124.018 0.927 . . . . 0.0 109.512 179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . 0.55 HD11 HD22 ' A' ' 81' ' ' LEU . 33.3 mm -55.16 -48.93 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 169.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.2 m -67.91 -26.62 66.07 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.367 -171.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 23.7 ttm105 -79.27 -16.03 57.06 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 126.852 2.061 . . . . 0.0 111.728 177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.91 0 N-CA-C 108.688 -1.765 . . . . 0.0 108.688 174.569 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 tpt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.564 0.221 . . . . 0.0 111.242 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -65.47 116.9 7.23 Favored 'General case' 0 CA--C 1.517 -0.313 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.54 HD23 ' HA3' ' A' ' 147' ' ' GLY . 4.0 mm? -59.15 -39.05 81.23 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.651 0.78 . . . . 0.0 110.023 175.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.9 p -59.55 -14.97 15.2 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 124.937 1.295 . . . . 0.0 112.025 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -84.0 -27.14 28.63 Favored 'General case' 0 C--N 1.344 0.35 0 C-N-CA 123.951 0.901 . . . . 0.0 113.404 174.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 93.5 m-85 -96.95 -39.01 9.58 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 122.889 0.476 . . . . 0.0 111.393 -174.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.43 ' CE2' HD11 ' A' ' 12' ' ' ILE . 0.1 OUTLIER -89.03 127.02 57.22 Favored Pre-proline 0 CA--C 1.551 0.997 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -173.519 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -69.44 -76.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 122.552 2.168 . . . . 0.0 113.131 -170.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.422 ' C ' ' H ' ' A' ' 11' ' ' SER . 32.1 tt0 -166.39 -62.08 0.03 OUTLIER 'General case' 0 C--O 1.231 0.107 0 C-N-CA 125.317 1.447 . . . . 0.0 109.886 -177.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.04 11.75 0.28 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.93 1.692 . . . . 0.0 112.149 175.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.422 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -68.87 -23.33 64.2 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 126.938 2.095 . . . . 0.0 111.429 -169.642 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.447 HG13 ' HB2' ' A' ' 141' ' ' ALA . 13.6 mm -98.99 139.34 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.298 0 C-N-CA 124.604 1.161 . . . . 0.0 108.016 -169.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.6 m -158.91 128.46 5.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 118.398 0.545 . . . . 0.0 109.857 169.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 p -96.74 142.94 13.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 N-CA-C 105.613 -1.995 . . . . 0.0 105.613 168.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.412 HD13 HG21 ' A' ' 15' ' ' ILE . 21.4 mt -138.31 148.61 24.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 106.383 -1.71 . . . . 0.0 106.383 -169.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -65.72 -48.72 71.01 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.451 -0.781 . . . . 0.0 110.309 169.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -169.67 148.46 3.66 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 105.334 -2.099 . . . . 0.0 105.334 -178.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.34 153.47 42.33 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 171.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -54.49 -43.23 71.61 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 123.381 0.673 . . . . 0.0 110.093 173.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -163.58 177.07 9.08 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 126.938 2.095 . . . . 0.0 107.765 169.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -54.81 -36.39 64.91 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 126.285 1.834 . . . . 0.0 113.937 175.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.408 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.8 mt-30 -62.52 -49.79 73.94 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 120.328 1.422 . . . . 0.0 108.459 171.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -60.65 -31.46 70.68 Favored 'General case' 0 C--O 1.222 -0.362 0 O-C-N 122.067 -0.396 . . . . 0.0 111.833 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.39 -36.57 83.17 Favored 'General case' 0 N--CA 1.451 -0.392 0 O-C-N 121.473 -0.767 . . . . 0.0 110.221 -178.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.3 -45.06 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 169.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -57.4 -46.56 83.33 Favored 'General case' 0 C--O 1.225 -0.212 0 C-N-CA 122.959 0.503 . . . . 0.0 110.163 -176.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -63.43 -36.15 82.78 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.976 1.31 . . . . 0.0 111.771 172.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.5 m -62.66 -21.38 65.67 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 119.636 1.107 . . . . 0.0 112.504 174.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.7 mmt -122.43 -18.82 6.6 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 -169.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.7 p -60.88 -35.92 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-N 121.152 1.796 . . . . 0.0 111.74 -171.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -67.16 -21.58 65.8 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.968 0.804 . . . . 0.0 111.998 179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.8 mt -83.41 -43.97 15.31 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.166 0.986 . . . . 0.0 108.658 171.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 34.2 tp -57.19 -42.85 82.01 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.331 1.052 . . . . 0.0 111.038 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.91 -30.14 67.6 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 126.271 1.829 . . . . 0.0 113.256 -176.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mttm -108.93 20.73 18.11 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.377 0.0 OUTLIER 42.4 38.48 1.22 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 127.379 2.272 . . . . 0.0 115.38 -172.533 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -66.19 -21.18 66.31 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.416 -0.802 . . . . 0.0 110.081 168.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.1 pt -149.05 175.91 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 127.074 2.15 . . . . 0.0 108.488 -173.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 78.5 p -113.58 166.33 11.63 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.458 1.503 . . . . 0.0 108.486 169.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.46 -28.16 69.78 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.023 -1.048 . . . . 0.0 111.327 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -61.49 -38.08 86.0 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 121.679 -0.638 . . . . 0.0 111.301 176.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -57.11 -48.0 79.7 Favored 'General case' 0 N--CA 1.457 -0.098 0 C-N-CA 123.607 0.763 . . . . 0.0 109.85 178.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.0 mt -59.04 -50.39 79.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 124.99 1.316 . . . . 0.0 109.04 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -68.05 -27.34 66.43 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.954 -174.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.96 -43.38 86.42 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 119.4 1.0 . . . . 0.0 110.651 172.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 18.3 mt -68.06 -49.39 68.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.408 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 86.3 mttt -60.24 -47.09 87.46 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 -174.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.64 -44.17 94.63 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.607 0.763 . . . . 0.0 110.923 -175.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.6 m -63.01 -44.5 95.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 122.989 0.516 . . . . 0.0 110.02 175.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 90.9 m -57.75 -40.66 80.22 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.759 0.824 . . . . 0.0 111.516 176.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 74.1 mt -68.55 -47.82 75.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-N 119.325 0.966 . . . . 0.0 109.837 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -78.22 -31.16 49.19 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -169.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -122.72 -8.25 8.47 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 124.674 1.19 . . . . 0.0 112.505 -169.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 85.44 166.55 42.08 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 107.968 -2.053 . . . . 0.0 107.968 -168.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -63.59 148.83 92.14 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 CA-C-N 119.403 1.602 . . . . 0.0 109.695 -179.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -134.29 17.47 3.72 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.481 -169.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -140.37 77.18 1.59 Allowed 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 126.669 1.987 . . . . 0.0 107.329 175.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 50.1 mm -128.58 143.64 40.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 105.494 -2.039 . . . . 0.0 105.494 -177.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.2 mp -132.02 -31.51 1.48 Allowed 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -169.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -163.53 163.45 16.38 Favored Pre-proline 0 C--O 1.236 0.351 0 C-N-CA 124.881 1.272 . . . . 0.0 107.596 -175.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.25 112.01 0.47 Allowed 'Trans proline' 0 N--CA 1.456 -0.698 0 C-N-CA 123.25 2.633 . . . . 0.0 111.846 171.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.17 4.69 77.54 Favored Glycine 0 CA--C 1.532 1.116 0 CA-C-O 117.471 -1.738 . . . . 0.0 114.618 176.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.49 126.89 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 119.977 1.889 . . . . 0.0 109.572 -169.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -127.76 171.01 12.11 Favored 'General case' 0 C--O 1.234 0.242 0 C-N-CA 125.879 1.672 . . . . 0.0 109.875 177.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.587 ' HE2' HD12 ' A' ' 122' ' ' LEU . 9.1 ttm -146.72 66.17 10.53 Favored Pre-proline 0 CA--C 1.54 0.578 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 179.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -50.67 137.05 42.08 Favored 'Trans proline' 0 CA--C 1.547 1.138 0 C-N-CA 121.178 1.252 . . . . 0.0 112.972 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -177.56 155.75 1.1 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 129.776 3.23 . . . . 0.0 105.279 -170.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.11 163.44 30.81 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 124.557 1.143 . . . . 0.0 108.336 171.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 -52.11 139.08 35.22 Favored Pre-proline 0 CA--C 1.54 0.558 0 CA-C-O 118.024 -0.988 . . . . 0.0 109.413 175.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_exo -44.67 -47.91 10.98 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 123.961 3.107 . . . . 0.0 113.335 -177.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -69.11 -4.26 16.56 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -175.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 73.7 m -78.94 -4.32 49.27 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.233 -0.917 . . . . 0.0 111.976 172.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 136.62 13.64 0.96 Allowed Glycine 0 CA--C 1.526 0.747 0 CA-C-N 119.485 1.039 . . . . 0.0 114.135 174.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.73 147.74 52.23 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 119.566 1.683 . . . . 0.0 108.804 169.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 80.2 mt -131.23 -31.89 1.62 Allowed 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 124.65 1.18 . . . . 0.0 110.197 -175.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -144.91 154.61 42.79 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 125.311 1.444 . . . . 0.0 108.522 175.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 37.5 m -86.64 129.68 34.78 Favored 'General case' 0 N--CA 1.439 -1.024 0 C-N-CA 123.394 0.678 . . . . 0.0 109.886 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.23 -175.75 38.72 Favored Glycine 0 CA--C 1.527 0.808 0 C-N-CA 123.816 0.722 . . . . 0.0 111.313 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 49.5 mtp -145.09 170.14 16.77 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.242 1.417 . . . . 0.0 110.844 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 33.0 m -157.27 173.34 17.09 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.165 1.786 . . . . 0.0 108.701 170.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 12.3 tp -148.21 116.45 6.51 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.071 1.348 . . . . 0.0 110.904 -168.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 87.8 m -118.37 143.68 46.47 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 125.081 1.352 . . . . 0.0 108.746 -177.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -134.85 143.44 47.01 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 171.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 10.4 mp -121.72 133.08 54.94 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 126.124 1.77 . . . . 0.0 106.313 178.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -67.14 -48.04 69.24 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 121.793 -0.567 . . . . 0.0 110.913 177.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -88.1 -15.95 34.83 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 123.555 0.742 . . . . 0.0 112.001 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.92 -178.21 21.27 Favored Glycine 0 CA--C 1.532 1.1 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -168.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -145.32 167.57 9.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 169.255 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -121.5 93.35 3.98 Favored 'General case' 0 C--N 1.333 -0.12 0 O-C-N 121.805 -0.56 . . . . 0.0 110.799 -169.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -48.88 138.64 12.53 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 123.743 0.817 . . . . 0.0 110.616 169.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -62.93 133.35 41.1 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 122.342 2.028 . . . . 0.0 110.827 -172.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 70.82 5.84 58.22 Favored Glycine 0 CA--C 1.532 1.142 0 CA-C-O 118.244 -1.309 . . . . 0.0 114.741 172.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -73.3 168.9 18.22 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 120.07 1.935 . . . . 0.0 110.05 173.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -67.55 -37.43 82.67 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 121.552 -0.717 . . . . 0.0 111.824 176.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -155.25 167.39 14.22 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.383 1.073 . . . . 0.0 111.942 -170.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -74.89 159.81 41.24 Favored 'Trans proline' 0 C--N 1.348 0.538 0 C-N-CA 123.045 2.496 . . . . 0.0 111.7 177.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.7 mm -113.49 138.32 43.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.298 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 -178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 21.3 mtpp -112.05 -19.63 12.25 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 117.291 -1.338 . . . . 0.0 111.03 174.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 49.6 tp -133.66 131.71 39.85 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 120.218 1.372 . . . . 0.0 109.424 -170.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.6 mp -138.4 135.1 34.94 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -175.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.438 ' HB ' HD11 ' A' ' 122' ' ' LEU . 2.0 mt -113.12 127.84 70.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 169.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -81.22 145.89 25.91 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 107.634 -2.186 . . . . 0.0 107.634 169.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.402 HD12 HD23 ' A' ' 118' ' ' LEU . 6.9 tt -143.62 132.6 22.84 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 104.756 -2.313 . . . . 0.0 104.756 169.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 85.3 p -124.39 153.39 41.94 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 169.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -152.87 133.06 13.51 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 118.343 0.52 . . . . 0.0 110.189 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.24 -22.06 58.16 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.024 0.53 . . . . 0.0 111.938 177.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -148.65 156.32 42.24 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.311 1.044 . . . . 0.0 109.642 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.41 -34.49 72.53 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -177.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -74.64 -30.94 61.8 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 120.749 -1.219 . . . . 0.0 111.065 177.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.1 m -67.16 -37.1 83.19 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.632 -0.668 . . . . 0.0 110.342 171.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 18.3 t60 -59.04 -49.02 79.48 Favored 'General case' 0 C--N 1.34 0.187 0 C-N-CA 123.857 0.863 . . . . 0.0 109.585 170.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 14.7 mm -54.29 -49.62 62.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 176.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.16 -42.79 97.32 Favored Glycine 0 CA--C 1.531 1.071 0 CA-C-N 119.199 0.908 . . . . 0.0 112.478 -178.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.42 -40.47 67.09 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.398 0.679 . . . . 0.0 111.199 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.455 ' HA ' ' HG ' ' A' ' 118' ' ' LEU . 8.4 mm -58.03 -47.0 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.874 0 C-N-CA 125.391 1.477 . . . . 0.0 107.501 173.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -67.74 0.15 3.55 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 125.347 1.459 . . . . 0.0 112.661 178.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -100.3 -54.76 2.78 Favored 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 124.824 1.25 . . . . 0.0 107.868 169.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.457 HD12 ' N ' ' A' ' 119' ' ' SER . 1.4 pp -64.43 -21.68 66.72 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 113.877 1.065 . . . . 0.0 113.877 -178.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.457 ' N ' HD12 ' A' ' 118' ' ' LEU . 54.5 p -59.39 -30.39 68.41 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 123.62 0.768 . . . . 0.0 111.844 175.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -70.14 -11.15 60.68 Favored 'General case' 0 C--O 1.233 0.229 0 O-C-N 121.545 -0.722 . . . . 0.0 110.975 176.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.517 ' HA ' HG21 ' A' ' 127' ' ' ILE . 35.2 mt -110.64 -63.62 1.37 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.115 0.966 . . . . 0.0 111.008 176.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.587 HD12 ' HE2' ' A' ' 65' ' ' MET . 17.1 mt -70.6 -17.3 62.9 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -172.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.1 m -111.85 27.78 9.35 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.597 0.759 . . . . 0.0 110.402 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -132.8 97.7 4.11 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 107.227 -1.397 . . . . 0.0 107.227 178.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -57.85 -28.33 64.02 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.232 -175.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -67.27 -42.55 83.68 Favored 'General case' 0 C--O 1.23 0.072 0 CA-C-O 121.303 0.573 . . . . 0.0 109.772 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.517 HG21 ' HA ' ' A' ' 121' ' ' LEU . 1.2 mp -69.05 -42.94 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.484 HD21 ' HA ' ' A' ' 122' ' ' LEU . 40.2 mt -54.09 -44.98 71.66 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 118.893 -0.575 . . . . 0.0 111.061 -175.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -69.7 -34.99 74.69 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 118.244 0.475 . . . . 0.0 110.109 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -72.28 -35.22 68.66 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 118.946 0.794 . . . . 0.0 109.883 -177.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 28.9 mt -67.28 -52.15 44.16 Favored 'General case' 0 C--O 1.225 -0.203 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 170.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.4 -24.66 56.79 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 66.9 p -105.46 5.33 31.49 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.737 1.215 . . . . 0.0 112.122 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -56.5 116.45 3.11 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 119.181 0.9 . . . . 0.0 110.413 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.3 m -68.63 -29.39 67.88 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 125.354 1.462 . . . . 0.0 111.342 178.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 33.1 m -147.68 164.33 33.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 124.971 1.309 . . . . 0.0 109.855 -169.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -54.6 -39.08 67.49 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 125.14 1.376 . . . . 0.0 110.389 178.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -56.08 -39.89 72.8 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.939 0.896 . . . . 0.0 112.389 -176.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -61.45 -43.99 97.89 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 118.824 0.738 . . . . 0.0 110.851 -179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.6 mt -62.87 -49.54 74.43 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -178.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.447 ' HB2' HG13 ' A' ' 12' ' ' ILE . . . -60.05 -27.89 67.33 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 174.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -81.24 -39.43 25.36 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 119.05 0.841 . . . . 0.0 110.6 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 63.4 mt -66.95 -33.0 60.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 C-N-CA 123.958 0.903 . . . . 0.0 109.253 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 1.1 mm -48.37 -47.77 14.09 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.75 1.22 . . . . 0.0 111.287 169.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 16.3 m -66.18 -18.61 65.45 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.789 0.836 . . . . 0.0 112.562 -169.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 32.1 ttp85 -53.82 -35.67 61.68 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.696 1.198 . . . . 0.0 112.93 173.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . 0.54 ' HA3' HD23 ' A' ' 3' ' ' LEU . . . . . . . . 0 C--O 1.247 0.953 0 N-CA-C 107.876 -2.09 . . . . 0.0 107.876 -173.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.872 0.367 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.44 ' HD2' ' HA ' ' A' ' 2' ' ' ARG . 6.3 mmm180 -68.12 114.18 6.4 Favored 'General case' 0 CA--C 1.509 -0.615 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.164 -175.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.0 -34.35 74.67 Favored 'General case' 0 C--O 1.223 -0.296 0 CA-C-O 118.735 -0.65 . . . . 0.0 109.754 175.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.1 m -55.16 -15.92 2.68 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 119.0 0.818 . . . . 0.0 113.079 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -62.38 -23.32 66.74 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 172.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -106.5 -19.1 13.78 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -169.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -105.58 100.46 26.79 Favored Pre-proline 0 N--CA 1.472 0.641 0 CA-C-N 120.657 1.571 . . . . 0.0 107.589 -169.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -59.51 -67.41 0.05 OUTLIER 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.462 2.775 . . . . 0.0 114.135 -170.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -162.26 -72.98 0.05 Allowed 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 123.78 0.832 . . . . 0.0 111.485 -174.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.7 m -67.75 2.6 1.83 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.559 1.144 . . . . 0.0 112.009 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -68.52 -14.84 63.28 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.825 1.65 . . . . 0.0 112.745 -169.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.4 mt -117.8 130.35 72.81 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.987 0 N-CA-C 105.123 -2.177 . . . . 0.0 105.123 -169.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 75.8 m -156.9 149.38 23.31 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 121.51 0.671 . . . . 0.0 111.231 -177.675 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.4 t -117.96 141.38 37.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 105.632 -1.988 . . . . 0.0 105.632 169.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.2 mt -135.37 145.01 32.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 125.602 1.561 . . . . 0.0 107.767 -169.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -68.19 -36.3 79.37 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.878 -0.514 . . . . 0.0 111.909 176.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 p -179.54 146.61 0.28 Allowed 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.802 2.041 . . . . 0.0 106.346 -177.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.79 154.12 36.47 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 169.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.53 -42.94 83.89 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.215 0.606 . . . . 0.0 109.778 174.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -166.07 177.88 6.72 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 128.34 2.656 . . . . 0.0 107.29 172.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.46 -37.49 65.27 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 126.352 1.861 . . . . 0.0 114.015 175.354 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.446 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.1 mt-30 -62.03 -50.4 72.17 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 120.316 1.416 . . . . 0.0 108.364 172.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -60.04 -31.33 69.86 Favored 'General case' 0 C--O 1.222 -0.348 0 O-C-N 122.039 -0.413 . . . . 0.0 111.808 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -67.24 -38.01 84.48 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.582 -0.699 . . . . 0.0 110.234 -179.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.9 -45.35 91.44 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 169.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -56.69 -44.87 81.92 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 122.696 0.398 . . . . 0.0 110.208 -176.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -69.42 -28.29 66.01 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.758 1.223 . . . . 0.0 112.466 174.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m -64.71 -20.94 66.61 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 119.953 1.251 . . . . 0.0 111.53 170.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.4 mmt -122.69 -21.47 5.63 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 -169.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.7 p -59.26 -35.27 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 120.944 1.702 . . . . 0.0 112.16 -169.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.5 m -64.43 -30.97 72.0 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.039 0.836 . . . . 0.0 111.417 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 88.7 mt -77.41 -43.22 33.33 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.807 0.843 . . . . 0.0 108.821 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 28.3 tp -56.67 -41.42 77.22 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.825 0.85 . . . . 0.0 110.956 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -67.61 -29.1 68.35 Favored 'General case' 0 C--O 1.231 0.108 0 C-N-CA 124.992 1.317 . . . . 0.0 112.78 -171.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -99.71 16.45 23.49 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.09 0.405 . . . . 0.0 110.654 172.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.336 3.4 p30 44.9 46.54 9.02 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.969 1.708 . . . . 0.0 114.167 -171.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 38.2 m-85 -72.73 -19.96 61.29 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.596 -0.69 . . . . 0.0 109.14 167.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 34.1 pt -142.36 172.99 7.87 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 127.242 2.217 . . . . 0.0 108.531 -178.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m -108.23 159.03 16.94 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.165 1.786 . . . . 0.0 108.195 170.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -60.75 -33.72 73.36 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.86 -1.15 . . . . 0.0 111.74 -178.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -62.34 -25.63 68.0 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.273 -0.892 . . . . 0.0 113.091 175.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -63.3 -45.73 90.01 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 119.521 1.055 . . . . 0.0 109.591 174.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.7 mt -59.9 -51.26 74.95 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 124.75 1.22 . . . . 0.0 108.816 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -68.75 -24.54 64.46 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 118.143 -0.932 . . . . 0.0 111.718 -174.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.5 -42.52 82.92 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.661 1.119 . . . . 0.0 110.765 172.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 14.9 mt -69.86 -49.22 58.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.446 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.8 mttt -59.81 -42.16 92.83 Favored 'General case' 0 C--O 1.224 -0.269 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -174.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -60.42 -48.07 83.37 Favored 'General case' 0 C--O 1.231 0.105 0 C-N-CA 123.734 0.814 . . . . 0.0 111.532 -176.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.6 m -62.55 -43.32 99.1 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.309 0.504 . . . . 0.0 110.456 176.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 42.1 m -58.97 -41.75 88.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.527 0.731 . . . . 0.0 111.29 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 65.3 mt -69.6 -41.33 80.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.188 0.995 . . . . 0.0 109.796 177.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -62.48 -34.39 76.75 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 123.597 0.759 . . . . 0.0 112.777 -170.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -149.63 -52.96 0.16 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.232 0.613 . . . . 0.0 110.622 -168.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 162.15 174.49 32.11 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 108.691 -1.764 . . . . 0.0 108.691 178.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_exo -50.36 152.21 8.79 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 123.199 2.599 . . . . 0.0 113.583 175.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -118.34 3.93 11.89 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.488 1.115 . . . . 0.0 111.5 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -139.5 67.03 1.39 Allowed 'General case' 0 C--O 1.225 -0.208 0 C-N-CA 124.689 1.196 . . . . 0.0 109.311 -169.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.5 mm -118.02 138.71 47.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 106.453 -1.684 . . . . 0.0 106.453 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -124.18 -33.36 3.09 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.255 0.622 . . . . 0.0 112.183 -169.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.51 164.19 20.0 Favored Pre-proline 0 CA--C 1.535 0.372 0 C-N-CA 124.844 1.258 . . . . 0.0 107.794 -176.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -46.32 112.72 0.5 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.412 2.741 . . . . 0.0 111.997 172.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.41 5.38 85.04 Favored Glycine 0 CA--C 1.532 1.102 0 CA-C-O 117.792 -1.56 . . . . 0.0 114.677 176.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 59.9 t -127.26 122.92 60.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 120.066 1.933 . . . . 0.0 108.896 -169.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.71 171.1 10.36 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 125.802 1.641 . . . . 0.0 109.998 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.492 ' CE ' HD11 ' A' ' 118' ' ' LEU . 9.1 ttm -141.31 58.76 9.31 Favored Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 123.997 0.919 . . . . 0.0 111.516 179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -56.32 128.12 28.83 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 121.807 1.671 . . . . 0.0 110.535 -176.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -179.11 162.69 1.24 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 127.809 2.444 . . . . 0.0 106.719 -169.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -137.83 171.79 13.91 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.791 1.237 . . . . 0.0 109.237 -175.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 -57.71 154.09 27.94 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-O 118.375 -0.822 . . . . 0.0 109.632 171.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -57.38 -40.17 83.74 Favored 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 122.499 2.132 . . . . 0.0 109.488 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.67 -16.97 30.29 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.948 2.099 . . . . 0.0 113.179 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 84.2 m -77.1 -9.41 58.72 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 118.487 -0.768 . . . . 0.0 111.736 -178.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 135.78 17.26 0.84 Allowed Glycine 0 C--N 1.34 0.775 0 CA-C-O 118.234 -1.315 . . . . 0.0 113.859 175.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 148.42 51.78 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 119.435 1.617 . . . . 0.0 109.358 172.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 82.8 mt -129.24 -33.98 1.89 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 124.459 1.103 . . . . 0.0 110.685 -175.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.4 mttp -146.7 159.78 43.04 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 125.267 1.427 . . . . 0.0 108.524 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 85.2 m -92.47 125.47 37.13 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 123.379 0.672 . . . . 0.0 111.986 -175.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.62 -178.5 42.77 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 125.104 1.335 . . . . 0.0 111.294 -177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 13.1 mtm -147.36 169.79 18.71 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.962 1.705 . . . . 0.0 111.778 -176.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.4 m -136.88 161.02 37.16 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.503 1.921 . . . . 0.0 108.829 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 33.4 tp -143.03 106.28 4.57 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.818 2.047 . . . . 0.0 108.122 178.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.1 m -121.41 136.21 54.98 Favored 'General case' 0 C--N 1.333 -0.145 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -170.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tt -132.99 136.57 46.13 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 119.348 0.977 . . . . 0.0 108.404 175.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.0 mp -113.95 126.74 55.49 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 125.54 1.536 . . . . 0.0 107.311 -178.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -61.78 -40.77 96.33 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 123.323 0.649 . . . . 0.0 110.892 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -96.35 -10.75 27.03 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.829 0.851 . . . . 0.0 112.175 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 61.3 -173.74 6.53 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 -169.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -150.27 168.27 2.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 168.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -125.94 92.42 3.59 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-O 121.5 0.666 . . . . 0.0 110.203 -170.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -49.0 140.49 11.43 Favored Pre-proline 0 CA--C 1.537 0.45 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.337 171.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -62.65 141.29 85.2 Favored 'Trans proline' 0 N--CA 1.454 -0.843 0 C-N-CA 122.18 1.92 . . . . 0.0 110.081 179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 73.7 -5.63 22.49 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 118.169 -1.351 . . . . 0.0 114.978 172.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -75.99 166.22 23.81 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 120.252 2.026 . . . . 0.0 110.056 175.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -70.98 -35.42 72.12 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.61 -0.681 . . . . 0.0 112.329 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -153.34 168.05 12.32 Favored Pre-proline 0 CA--C 1.546 0.813 0 C-N-CA 123.974 0.91 . . . . 0.0 112.161 -169.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -73.68 159.5 45.58 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.819 2.346 . . . . 0.0 111.453 178.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 38.0 mm -113.55 137.4 46.79 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 -179.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 22.4 mtpp -114.01 -15.13 12.35 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 116.519 -1.705 . . . . 0.0 111.146 175.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.514 HD13 HD13 ' A' ' 131' ' ' LEU . 0.6 OUTLIER -138.73 144.06 39.33 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 121.249 1.841 . . . . 0.0 111.982 175.171 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.8 mp -139.37 109.79 6.57 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 125.654 1.582 . . . . 0.0 107.386 -173.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.457 ' HB ' HD11 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -84.9 135.6 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 168.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -97.88 154.81 20.32 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 109.218 -1.553 . . . . 0.0 109.218 170.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.519 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -152.11 144.54 24.1 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 107.339 -1.356 . . . . 0.0 107.339 173.511 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.519 ' N ' HD23 ' A' ' 103' ' ' LEU . 82.5 p -142.53 145.05 33.23 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 168.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.643 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -144.1 146.91 33.11 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 119.27 0.941 . . . . 0.0 109.642 169.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -79.01 -14.56 59.12 Favored 'General case' 0 N--CA 1.45 -0.475 0 C-N-CA 120.624 -0.43 . . . . 0.0 111.483 -176.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -136.97 151.0 48.51 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.436 0.694 . . . . 0.0 110.202 176.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.43 -35.38 77.4 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -176.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -72.6 -30.39 64.32 Favored 'General case' 0 N--CA 1.467 0.397 0 O-C-N 121.139 -0.976 . . . . 0.0 110.917 176.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.43 ' HB2' ' HB1' ' A' ' 105' ' ' ALA . 19.6 m -66.46 -36.45 82.81 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.383 169.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.643 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 27.3 m-70 -61.55 -45.79 92.66 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 119.303 0.956 . . . . 0.0 109.969 170.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 20.8 mm -55.7 -51.76 55.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 118.985 0.811 . . . . 0.0 109.274 177.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.26 -41.8 96.97 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-N 118.854 0.752 . . . . 0.0 111.669 -178.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.37 -43.68 73.08 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.492 0.717 . . . . 0.0 111.22 -179.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.8 mm -59.11 -46.47 91.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 C-N-CA 124.847 1.259 . . . . 0.0 108.282 175.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -68.03 -12.05 60.1 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.352 -0.843 . . . . 0.0 111.562 -178.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -91.52 -50.16 5.93 Favored 'General case' 0 N--CA 1.44 -0.954 0 C-N-CA 124.216 1.006 . . . . 0.0 109.089 173.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.492 HD11 ' CE ' ' A' ' 65' ' ' MET . 4.2 pp -69.01 -26.81 65.2 Favored 'General case' 0 N--CA 1.449 -0.491 0 O-C-N 121.69 -0.631 . . . . 0.0 111.478 -176.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 41.8 m -62.16 -22.18 65.66 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 119.118 -0.467 . . . . 0.0 112.168 173.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -65.97 -16.7 64.12 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.396 0.998 . . . . 0.0 110.336 172.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 34.1 mt -106.3 -60.91 1.59 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.612 1.565 . . . . 0.0 110.115 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.488 HD12 ' HE2' ' A' ' 65' ' ' MET . 13.6 mt -69.15 -17.51 63.83 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -173.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 44.3 m -113.03 27.38 9.67 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 119.046 0.839 . . . . 0.0 110.595 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -139.31 96.87 3.17 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 -170.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.44 -25.77 38.24 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.296 1.038 . . . . 0.0 112.737 -174.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.34 -45.8 89.54 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.373 0.606 . . . . 0.0 109.896 176.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -72.15 -38.21 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 44.3 mt -59.06 -33.37 70.71 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 119.312 0.96 . . . . 0.0 111.468 178.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -68.27 -43.34 78.02 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 120.858 -1.151 . . . . 0.0 110.334 172.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -64.73 -33.36 75.78 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.599 0.636 . . . . 0.0 110.665 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.514 HD13 HD13 ' A' ' 99' ' ' LEU . 2.6 pp -78.11 -45.41 23.44 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-O 118.345 -0.836 . . . . 0.0 110.119 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 53.8 mt -62.97 -24.03 67.7 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 120.225 1.375 . . . . 0.0 112.395 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 52.4 p -94.36 1.0 55.89 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 123.984 0.914 . . . . 0.0 111.646 177.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.96 107.67 2.76 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.131 0.878 . . . . 0.0 110.944 -176.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.2 p -77.42 -24.24 50.47 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.776 1.23 . . . . 0.0 112.208 176.188 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 29.8 m -147.55 157.47 43.57 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.86 0.864 . . . . 0.0 111.32 -169.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -50.04 -42.25 49.22 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.963 2.105 . . . . 0.0 111.643 177.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -70.57 -21.97 62.63 Favored 'General case' 0 CA--C 1.527 0.081 0 O-C-N 121.452 -0.78 . . . . 0.0 112.559 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 27.1 tp60 -76.42 -32.2 58.36 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 120.163 1.347 . . . . 0.0 109.468 173.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.48 -43.42 76.99 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.269 -0.894 . . . . 0.0 108.642 174.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -56.44 -38.93 72.29 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 170.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -62.18 -39.01 91.29 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 119.154 0.888 . . . . 0.0 111.191 178.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 86.4 mt -62.03 -43.48 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.453 0.701 . . . . 0.0 109.578 175.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 18.0 mm -58.92 -43.56 88.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.251 0 C-N-CA 122.792 0.437 . . . . 0.0 110.299 176.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 52.3 m -72.67 -26.75 61.74 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 122.017 -0.427 . . . . 0.0 111.831 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.0 ttt180 -70.06 -40.43 75.06 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.305 1.042 . . . . 0.0 110.049 174.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 C-N-CA 124.639 1.114 . . . . 0.0 110.477 -174.623 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 N--CA 1.485 1.312 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -62.31 113.08 2.7 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 106.912 -1.514 . . . . 0.0 106.912 168.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -53.49 -43.34 68.16 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 124.146 0.978 . . . . 0.0 108.794 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -54.05 -21.62 8.81 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.158 1.383 . . . . 0.0 113.69 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -61.99 -26.12 68.03 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.73 1.15 . . . . 0.0 112.659 173.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 90.1 m-85 -97.85 -22.33 16.42 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 118.132 -0.937 . . . . 0.0 113.377 -171.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -104.04 101.16 24.11 Favored Pre-proline 0 N--CA 1.473 0.702 0 N-CA-C 105.342 -2.096 . . . . 0.0 105.342 -173.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.01 -77.66 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.075 2.517 . . . . 0.0 113.344 -169.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -159.54 160.09 34.12 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 127.146 2.178 . . . . 0.0 105.696 174.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.3 m 60.47 1.4 0.39 Allowed 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.587 1.555 . . . . 0.0 112.99 -177.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.26 -7.63 55.32 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 127.543 2.337 . . . . 0.0 112.766 -169.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.5 mt -120.42 129.41 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.935 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -169.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.7 p -147.67 146.88 29.47 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.495 0.664 . . . . 0.0 112.093 -175.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 93.7 t -127.47 136.52 60.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 171.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.0 mt -139.56 150.73 22.4 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 C-N-CA 125.981 1.713 . . . . 0.0 106.906 -169.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 55.3 t60 -75.3 -48.78 21.6 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.838 -0.539 . . . . 0.0 109.718 172.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 10.1 p -157.27 150.15 23.45 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 178.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.68 156.04 26.51 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 170.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -59.59 -31.21 69.26 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.161 175.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -166.37 173.7 9.75 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 126.844 2.057 . . . . 0.0 107.704 177.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 1.2 p90 -64.12 -33.44 75.77 Favored 'General case' 0 C--N 1.321 -0.67 0 C-N-CA 123.747 0.819 . . . . 0.0 111.501 169.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.423 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.5 mt-30 -59.23 -48.83 80.16 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 169.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -65.34 -30.89 71.78 Favored 'General case' 0 C--O 1.221 -0.411 0 O-C-N 122.048 -0.408 . . . . 0.0 111.438 -179.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.96 -36.8 83.03 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 121.529 -0.732 . . . . 0.0 110.026 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.32 -45.64 92.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 N-CA-C 108.01 -1.107 . . . . 0.0 108.01 169.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -56.65 -45.92 81.35 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 122.766 0.427 . . . . 0.0 110.296 -177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -67.14 -31.04 71.21 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.872 1.269 . . . . 0.0 112.172 174.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 20.1 m -64.61 -21.81 66.81 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.875 1.216 . . . . 0.0 111.979 172.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.6 mmt -123.36 -20.48 5.61 Favored 'General case' 0 CA--C 1.534 0.362 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -169.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.9 p -60.99 -34.18 58.78 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-N 121.03 1.741 . . . . 0.0 111.595 -171.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 14.0 m -62.35 -26.44 68.45 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.778 0.717 . . . . 0.0 111.755 178.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.0 mt -84.83 -40.97 16.52 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 124.105 0.962 . . . . 0.0 109.179 174.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.3 tp -56.4 -40.92 75.44 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.775 0.83 . . . . 0.0 110.828 178.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -66.62 -25.44 66.6 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 125.827 1.651 . . . . 0.0 113.788 -171.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -110.82 23.62 13.95 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.768 0.427 . . . . 0.0 110.019 172.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.305 3.7 p30 45.39 43.06 8.2 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.483 1.513 . . . . 0.0 114.191 -177.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.458 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 41.5 m-85 -71.18 -18.4 62.49 Favored 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.329 -0.857 . . . . 0.0 109.076 168.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.8 pt -145.8 170.77 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.323 2.249 . . . . 0.0 108.734 -178.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 38.4 m -107.44 161.19 15.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.052 1.741 . . . . 0.0 108.071 169.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -61.32 -30.94 70.81 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.066 -1.021 . . . . 0.0 112.349 -174.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -57.15 -36.2 70.45 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 121.686 -0.634 . . . . 0.0 111.823 176.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -58.07 -45.16 87.56 Favored 'General case' 0 N--CA 1.457 -0.101 0 C-N-CA 123.834 0.854 . . . . 0.0 110.319 -179.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 14.7 mt -61.83 -50.7 79.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 124.771 1.228 . . . . 0.0 108.486 178.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.9 tp60 -68.29 -26.57 65.71 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 118.089 -0.958 . . . . 0.0 111.924 -174.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.77 -44.91 86.52 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 119.491 1.041 . . . . 0.0 110.477 173.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.6 mt -69.28 -48.55 67.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.31 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.423 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 86.7 mttt -58.75 -47.68 83.81 Favored 'General case' 0 C--N 1.343 0.309 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -175.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.79 -44.04 94.55 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 123.996 0.918 . . . . 0.0 111.012 -176.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -61.22 -44.06 97.88 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 122.743 0.417 . . . . 0.0 110.129 176.011 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 85.1 m -61.09 -42.59 98.78 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.07 0.948 . . . . 0.0 111.164 178.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 73.5 mt -65.27 -42.32 93.62 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 CA-C-N 118.783 0.72 . . . . 0.0 109.481 176.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-80 -70.13 -38.44 75.53 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 113.455 0.909 . . . . 0.0 113.455 -171.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -144.97 12.84 1.44 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -167.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 80.87 168.42 39.38 Favored Glycine 0 CA--C 1.533 1.218 0 N-CA-C 110.49 -1.044 . . . . 0.0 110.49 -172.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -65.36 157.76 56.19 Favored 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 123.164 2.576 . . . . 0.0 112.22 -172.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -112.39 -11.24 13.69 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.081 0.952 . . . . 0.0 112.571 -170.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -136.54 77.95 1.68 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.242 1.017 . . . . 0.0 108.5 -169.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.6 mm -124.14 141.5 44.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 105.622 -1.992 . . . . 0.0 105.622 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.4 mp -130.38 -28.39 2.1 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -169.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.13 161.03 26.54 Favored Pre-proline 0 C--O 1.237 0.396 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -56.72 114.52 1.95 Allowed 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.017 1.811 . . . . 0.0 109.238 172.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.14 -4.87 57.41 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-O 117.792 -1.56 . . . . 0.0 114.2 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.1 t -129.22 128.53 66.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.93 1.865 . . . . 0.0 110.212 -169.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -131.67 167.39 19.54 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.292 1.837 . . . . 0.0 109.938 177.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.448 ' CE ' HD11 ' A' ' 118' ' ' LEU . 8.8 ttm -139.94 57.12 8.87 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 124.006 0.922 . . . . 0.0 112.151 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_exo -45.81 138.08 11.97 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 121.863 1.709 . . . . 0.0 114.175 179.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 178.44 154.88 0.39 Allowed 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 129.121 2.968 . . . . 0.0 105.67 -169.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -133.72 161.43 34.71 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 106.677 -1.601 . . . . 0.0 106.677 170.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -56.64 149.36 41.54 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-O 118.687 -0.673 . . . . 0.0 109.351 178.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -47.72 -41.01 31.54 Favored 'Trans proline' 0 CA--C 1.54 0.794 0 C-N-CA 123.131 2.554 . . . . 0.0 112.767 -177.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -62.74 -15.44 53.12 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.352 1.461 . . . . 0.0 113.285 -177.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 84.7 m -79.8 -2.01 41.4 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.86 0.864 . . . . 0.0 111.705 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.99 20.07 1.51 Allowed Glycine 0 CA--C 1.523 0.548 0 CA-C-O 118.493 -1.171 . . . . 0.0 112.941 174.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.39 148.91 48.97 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 119.415 1.607 . . . . 0.0 108.665 169.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.7 mt -129.53 -33.69 1.85 Allowed 'General case' 0 C--N 1.333 -0.147 0 C-N-CA 124.259 1.024 . . . . 0.0 110.529 -176.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.458 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 73.7 mttt -145.67 153.85 41.46 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 125.281 1.432 . . . . 0.0 107.694 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.7 m -84.8 126.55 33.53 Favored 'General case' 0 N--CA 1.441 -0.917 0 C-N-CA 122.854 0.462 . . . . 0.0 109.985 179.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.95 179.67 42.13 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.665 1.126 . . . . 0.0 110.385 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 60.3 mtp -147.82 168.47 22.1 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.298 1.039 . . . . 0.0 112.767 -173.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -138.65 164.14 30.28 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.251 1.821 . . . . 0.0 109.441 174.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.458 HD22 HD11 ' A' ' 144' ' ' ILE . 31.3 tp -146.77 100.93 3.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 127.135 2.174 . . . . 0.0 108.837 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.497 ' O ' HD22 ' A' ' 99' ' ' LEU . 92.2 m -117.27 135.19 54.0 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.316 1.046 . . . . 0.0 109.407 -172.689 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.4 tp -124.99 139.22 54.01 Favored 'General case' 0 CA--C 1.526 0.036 0 C-N-CA 123.795 0.838 . . . . 0.0 108.833 174.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.5 mp -118.3 126.41 52.07 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 126.519 1.928 . . . . 0.0 105.828 175.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -72.23 -35.23 68.79 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 119.039 0.836 . . . . 0.0 112.31 -178.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 52.1 mm-40 -81.07 -20.08 42.33 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.633 0.773 . . . . 0.0 111.241 172.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 65.2 -174.5 16.5 Favored Glycine 0 CA--C 1.532 1.142 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 -168.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -146.7 165.38 7.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 105.779 -1.934 . . . . 0.0 105.779 168.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -126.75 94.3 4.01 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -169.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -47.17 146.28 3.11 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 124.478 1.111 . . . . 0.0 110.948 174.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.5 -5.25 8.13 Favored 'Trans proline' 0 CA--C 1.537 0.638 0 C-N-CA 124.58 3.52 . . . . 0.0 117.858 -168.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -152.39 23.03 0.85 Allowed Glycine 0 CA--C 1.524 0.625 0 CA-C-N 120.119 1.327 . . . . 0.0 113.245 179.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -85.19 171.66 11.8 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 118.671 1.236 . . . . 0.0 111.792 -179.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -67.33 -42.69 83.16 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 122.884 0.473 . . . . 0.0 111.771 174.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -156.56 170.1 9.45 Favored Pre-proline 0 CA--C 1.544 0.739 0 C-N-CA 124.848 1.259 . . . . 0.0 111.652 -176.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -62.99 158.05 45.51 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.633 2.222 . . . . 0.0 112.558 177.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 40.5 mm -116.82 132.4 66.64 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 N-CA-C 106.97 -1.493 . . . . 0.0 106.97 178.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt -98.63 -35.48 10.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 117.658 -1.163 . . . . 0.0 109.55 169.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.497 HD22 ' O ' ' A' ' 82' ' ' THR . 3.2 tm? -115.51 129.96 56.72 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 119.804 1.184 . . . . 0.0 110.512 -169.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.6 mp -131.38 104.74 7.18 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.513 ' HB ' HD11 ' A' ' 122' ' ' LEU . 0.5 OUTLIER -80.27 138.96 18.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 106.279 -1.748 . . . . 0.0 106.279 168.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -99.42 148.88 18.81 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 108.312 -1.915 . . . . 0.0 108.312 169.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -145.75 137.55 25.21 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 106.001 -1.851 . . . . 0.0 106.001 169.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 92.6 p -132.07 147.44 52.44 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 126.305 1.842 . . . . 0.0 106.188 168.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -148.0 133.6 18.79 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 -178.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.15 -18.53 59.08 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 119.239 -0.41 . . . . 0.0 111.781 179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -144.25 153.38 41.98 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.852 0.861 . . . . 0.0 110.079 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.17 -35.23 74.88 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -74.48 -31.12 62.1 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 120.933 -1.104 . . . . 0.0 111.086 177.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.9 m -64.63 -39.2 93.29 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.845 -0.534 . . . . 0.0 110.261 170.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -58.55 -49.97 75.48 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 123.508 0.723 . . . . 0.0 109.798 171.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 16.4 mm -55.29 -52.13 48.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.94 -41.0 99.19 Favored Glycine 0 CA--C 1.53 1.02 0 CA-C-N 118.971 0.805 . . . . 0.0 111.761 -176.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.27 -46.61 73.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.483 0.713 . . . . 0.0 110.725 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.2 mm -57.72 -46.71 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 124.853 1.261 . . . . 0.0 108.632 176.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -68.21 -14.91 63.34 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.299 -0.876 . . . . 0.0 111.512 -176.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -90.15 -47.38 7.84 Favored 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 123.895 0.878 . . . . 0.0 109.539 174.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.448 HD11 ' CE ' ' A' ' 65' ' ' MET . 4.3 pp -70.58 -25.83 63.25 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 121.75 -0.594 . . . . 0.0 111.51 -176.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.0 m -60.77 -21.99 63.61 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 172.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -66.72 -17.13 64.7 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.35 0.977 . . . . 0.0 110.268 173.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 44.9 mt -105.71 -61.85 1.44 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.26 1.424 . . . . 0.0 109.883 177.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.513 HD11 ' HB ' ' A' ' 101' ' ' ILE . 16.6 mt -68.97 -12.73 61.93 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 -173.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.3 m -118.38 29.04 7.99 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.993 0.815 . . . . 0.0 110.4 177.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 69.6 mm-40 -131.86 99.71 4.84 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 124.577 1.151 . . . . 0.0 108.052 175.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -57.47 -25.6 59.96 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.038 -0.983 . . . . 0.0 112.488 -176.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -62.68 -48.98 76.91 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.139 0.576 . . . . 0.0 109.822 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.64 -41.26 85.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 C-N-CA 123.9 0.88 . . . . 0.0 108.814 178.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 122' ' ' LEU . 34.5 mt -53.91 -43.44 69.73 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 118.64 0.655 . . . . 0.0 111.605 -172.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -69.87 -32.31 70.6 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.449 0.568 . . . . 0.0 110.234 -178.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 63.9 mt-30 -71.18 -36.68 72.06 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 -178.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 48.6 mt -62.24 -55.57 27.13 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 169.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 58.2 mt -62.42 -9.43 8.35 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -172.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 67.9 p -121.78 4.83 10.0 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.342 1.457 . . . . 0.0 111.546 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.53 113.01 2.21 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 124.054 0.942 . . . . 0.0 110.527 -178.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.1 m -75.16 -22.49 58.07 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.632 0.773 . . . . 0.0 111.942 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.2 m -147.13 155.49 42.19 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 123.867 0.867 . . . . 0.0 109.895 -169.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -62.18 -31.93 72.49 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 123.775 0.83 . . . . 0.0 110.506 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -57.61 -36.5 71.85 Favored 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 123.06 0.544 . . . . 0.0 111.756 173.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -68.15 -38.07 81.74 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 123.75 0.82 . . . . 0.0 111.438 177.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 59.4 mt -68.46 -46.56 69.44 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 176.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -56.97 -35.2 68.87 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.277 1.031 . . . . 0.0 112.83 173.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -63.22 -45.18 92.82 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 119.36 0.982 . . . . 0.0 110.064 176.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 83.6 mt -62.73 -37.62 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 C-N-CA 123.955 0.902 . . . . 0.0 109.936 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . 0.458 HD11 HD22 ' A' ' 81' ' ' LEU . 25.0 mm -60.39 -49.01 85.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 118.412 0.551 . . . . 0.0 110.409 170.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 44.2 m -66.16 -24.96 66.74 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 -168.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.9 mtt180 -65.31 -33.52 76.17 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.85 0.75 . . . . 0.0 111.118 177.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.132 0 CA-C-O 117.52 -1.711 . . . . 0.0 109.197 -169.398 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.0 ttm . . . . . 0 N--CA 1.487 1.396 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 -64.17 114.27 4.09 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.172 -1.047 . . . . 0.0 108.172 169.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -54.35 -43.73 71.55 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 125.141 1.376 . . . . 0.0 109.457 -178.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.8 -18.43 8.52 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.246 1.418 . . . . 0.0 113.183 -177.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -66.99 -31.12 71.46 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-N 119.449 1.022 . . . . 0.0 111.648 176.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -87.86 -30.65 20.0 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 118.508 -0.758 . . . . 0.0 112.346 -173.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -91.13 109.81 37.97 Favored Pre-proline 0 CA--C 1.543 0.706 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -176.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -74.3 -83.55 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.796 0 C-N-CA 122.835 2.357 . . . . 0.0 112.625 -169.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -157.39 163.21 38.82 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 127.257 2.223 . . . . 0.0 106.113 172.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 57.58 5.06 0.28 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.771 1.628 . . . . 0.0 113.125 -175.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.4 p -81.98 1.28 36.21 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.734 2.814 . . . . 0.0 113.393 -168.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 8.4 mt -131.61 123.26 51.88 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -169.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.0 m -142.6 146.42 34.54 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 123.413 0.446 . . . . 0.0 111.488 -176.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 88.1 t -118.81 141.25 39.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 N-CA-C 105.496 -2.039 . . . . 0.0 105.496 169.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.3 mt -140.69 148.23 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 C-N-CA 125.714 1.606 . . . . 0.0 107.441 -169.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -69.37 -52.62 25.36 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 172.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.5 t -162.03 163.56 28.72 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.126 -1.435 . . . . 0.0 107.126 169.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -83.93 158.45 21.57 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.92 -0.771 . . . . 0.0 108.92 173.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -59.07 -43.43 91.75 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.419 174.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -164.53 177.41 8.14 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 128.031 2.532 . . . . 0.0 107.555 173.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -55.52 -37.88 68.49 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 126.028 1.731 . . . . 0.0 113.819 176.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.409 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 32.9 mt-30 -62.64 -49.71 74.09 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 120.158 1.345 . . . . 0.0 108.489 173.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -60.41 -33.28 72.28 Favored 'General case' 0 C--O 1.223 -0.314 0 O-C-N 121.906 -0.496 . . . . 0.0 111.707 178.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.32 -37.3 86.67 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.645 -0.66 . . . . 0.0 110.637 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.97 -47.14 89.34 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.127 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 170.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -58.87 -48.97 79.51 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 123.266 0.626 . . . . 0.0 110.374 -174.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -60.81 -31.32 70.72 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.508 1.123 . . . . 0.0 111.4 173.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.9 m -82.66 -9.02 59.56 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 119.566 1.075 . . . . 0.0 113.676 179.214 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 14.2 mmt -121.26 -20.93 6.54 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.12 0.873 . . . . 0.0 112.821 -176.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.8 p -57.47 -34.03 45.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-N 120.352 1.433 . . . . 0.0 111.982 -173.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.0 m -65.07 -29.43 70.31 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 119.211 0.914 . . . . 0.0 111.902 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.2 mt -79.5 -42.47 25.15 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.092 0.957 . . . . 0.0 108.737 173.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.6 -44.01 85.11 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.921 0.888 . . . . 0.0 110.763 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.6 -28.76 67.46 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 126.651 1.98 . . . . 0.0 113.136 -176.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -111.4 21.06 16.65 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 -175.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.292 0.7 OUTLIER 47.99 33.44 3.44 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.132 1.773 . . . . 0.0 114.67 -178.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -67.86 -22.18 65.13 Favored 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.865 -1.147 . . . . 0.0 111.318 169.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.1 pt -145.37 172.59 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 C-N-CA 126.26 1.824 . . . . 0.0 108.235 -174.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 m -108.98 161.04 15.53 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.618 1.567 . . . . 0.0 108.366 172.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.57 -32.54 72.64 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 120.863 -1.148 . . . . 0.0 111.464 -178.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 t30 -59.01 -36.31 74.71 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.771 -0.581 . . . . 0.0 111.877 175.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -58.73 -48.24 81.84 Favored 'General case' 0 N--CA 1.457 -0.106 0 C-N-CA 123.386 0.674 . . . . 0.0 109.487 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 28.8 mt -57.97 -49.91 79.68 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 C-N-CA 124.336 1.054 . . . . 0.0 108.923 178.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -68.19 -26.96 66.0 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 118.06 -0.971 . . . . 0.0 111.831 -175.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.24 -40.1 89.06 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.812 1.187 . . . . 0.0 110.815 172.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 34.7 mt -67.97 -51.91 44.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.409 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.0 mttt -58.9 -43.84 91.08 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -175.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -63.76 -45.76 88.35 Favored 'General case' 0 N--CA 1.456 -0.136 0 C-N-CA 124.465 1.106 . . . . 0.0 111.124 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 27.7 m -63.22 -38.2 90.22 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.402 0.546 . . . . 0.0 110.794 177.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 88.0 m -60.81 -48.46 81.68 Favored 'General case' 0 N--CA 1.45 -0.44 0 C-N-CA 124.136 0.974 . . . . 0.0 109.578 177.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 81.4 mt -65.11 -42.07 93.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 C-N-CA 123.261 0.624 . . . . 0.0 110.195 178.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -70.55 -36.8 73.87 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -171.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -144.77 -45.6 0.24 Allowed 'General case' 0 C--O 1.231 0.12 0 C-N-CA 122.933 0.493 . . . . 0.0 111.691 -168.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 154.12 164.82 13.13 Favored Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 177.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_endo -58.21 144.37 95.63 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.36 2.707 . . . . 0.0 111.275 -177.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.08 -40.72 64.26 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.827 1.251 . . . . 0.0 113.656 -170.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -150.76 140.58 21.83 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 107.491 -1.3 . . . . 0.0 107.491 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.7 mm -131.22 134.33 61.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 N-CA-C 102.179 -3.267 . . . . 0.0 102.179 172.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -116.92 -28.92 6.15 Favored 'General case' 0 C--N 1.332 -0.155 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -168.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -165.73 163.67 12.42 Favored Pre-proline 0 C--O 1.237 0.437 0 C-N-CA 125.311 1.444 . . . . 0.0 107.536 -177.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -46.52 116.88 1.76 Allowed 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 123.027 2.485 . . . . 0.0 110.993 169.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.8 0.93 83.28 Favored Glycine 0 CA--C 1.533 1.163 0 CA-C-O 117.47 -1.739 . . . . 0.0 114.888 175.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 63.2 t -127.83 126.59 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 120.232 2.016 . . . . 0.0 109.605 -170.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -128.15 164.58 22.17 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 125.595 1.558 . . . . 0.0 110.06 176.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 4.8 tmm? -149.05 76.95 9.35 Favored Pre-proline 0 C--O 1.223 -0.313 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 171.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -59.04 -89.01 0.0 OUTLIER 'Trans proline' 0 CA--C 1.55 1.286 0 C-N-CA 122.849 2.366 . . . . 0.0 114.985 -169.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . 0.254 0.0 OUTLIER 51.26 177.15 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.025 2.13 . . . . 0.0 113.943 -169.176 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.53 159.88 40.21 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 125.307 1.443 . . . . 0.0 108.568 177.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -62.53 147.78 91.75 Favored Pre-proline 0 CA--C 1.539 0.534 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.09 177.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_exo -44.58 -44.42 13.76 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 124.479 3.452 . . . . 0.0 114.032 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -61.42 -12.04 12.86 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.286 1.435 . . . . 0.0 113.843 -176.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 60.0 m -79.28 -4.15 49.38 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.615 0.643 . . . . 0.0 111.62 179.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 127.36 19.2 1.93 Allowed Glycine 0 C--N 1.337 0.622 0 CA-C-O 118.539 -1.145 . . . . 0.0 113.249 175.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.49 149.32 50.23 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 119.206 1.503 . . . . 0.0 109.075 169.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -130.78 -31.52 1.74 Allowed 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 124.375 1.07 . . . . 0.0 110.661 -174.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -146.18 157.35 43.82 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 125.011 1.324 . . . . 0.0 108.951 177.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.427 ' HA ' ' O ' ' A' ' 104' ' ' SER . 89.7 m -90.31 126.15 35.76 Favored 'General case' 0 N--CA 1.439 -1.022 0 C-N-CA 123.041 0.536 . . . . 0.0 110.203 -177.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -168.98 -174.52 37.62 Favored Glycine 0 CA--C 1.536 1.387 0 C-N-CA 125.482 1.515 . . . . 0.0 111.252 -175.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 40.8 mtt -151.42 170.06 20.5 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 126.103 1.761 . . . . 0.0 111.064 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 36.6 m -153.41 169.65 22.63 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.56 1.544 . . . . 0.0 109.931 171.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 18.1 tp -142.91 130.18 20.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 127.145 2.178 . . . . 0.0 109.561 -169.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.475 ' O ' HD22 ' A' ' 99' ' ' LEU . 35.7 m -136.52 133.86 36.93 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 -176.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 17.3 tp -125.38 134.51 52.14 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 171.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.5 mp -110.63 133.52 53.25 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 173.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -67.6 -43.87 79.46 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 118.308 0.504 . . . . 0.0 110.676 176.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 90.7 mm-40 -84.54 -24.73 29.17 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.806 0.842 . . . . 0.0 112.271 -177.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 71.69 165.54 7.27 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 110.72 -0.952 . . . . 0.0 110.72 -168.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -135.2 163.47 35.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 169.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -120.55 93.36 4.02 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.867 0.841 . . . . 0.0 111.422 -168.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -49.89 140.09 16.13 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 114.66 -1.154 . . . . 0.0 112.221 171.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -65.25 159.25 48.06 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 122.36 2.04 . . . . 0.0 109.835 169.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 77.18 -35.14 1.5 Allowed Glycine 0 CA--C 1.534 1.232 0 C-N-CA 124.373 0.987 . . . . 0.0 113.039 178.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.427 HD21 HD11 ' A' ' 97' ' ' ILE . 40.7 t-20 -68.79 177.87 2.37 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.079 1.352 . . . . 0.0 110.25 169.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -114.0 -20.09 11.16 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.295 1.038 . . . . 0.0 113.256 -174.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -149.66 163.26 25.6 Favored Pre-proline 0 CA--C 1.539 0.535 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -179.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -58.16 152.87 49.51 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.31 2.673 . . . . 0.0 112.93 176.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.427 HD11 HD21 ' A' ' 93' ' ' ASN . 38.6 mm -115.81 128.23 73.13 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.389 0 N-CA-C 106.373 -1.714 . . . . 0.0 106.373 174.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -94.43 -34.01 12.9 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 117.458 -1.258 . . . . 0.0 109.858 169.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.475 HD22 ' O ' ' A' ' 82' ' ' THR . 3.1 tm? -119.51 131.15 55.5 Favored 'General case' 0 CA--C 1.512 -0.485 0 CA-C-N 120.333 1.424 . . . . 0.0 110.17 -169.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mp -129.37 135.4 48.67 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -111.32 132.16 60.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 N-CA-C 105.31 -2.107 . . . . 0.0 105.31 168.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -103.38 157.46 17.66 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 172.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.478 HD23 ' N ' ' A' ' 104' ' ' SER . 0.7 OUTLIER -146.95 154.59 41.44 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 104.1 -2.556 . . . . 0.0 104.1 -179.827 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.478 ' N ' HD23 ' A' ' 103' ' ' LEU . 88.3 p -142.85 146.15 33.85 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 104.63 -2.359 . . . . 0.0 104.63 168.324 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -150.23 129.43 12.77 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 119.535 1.061 . . . . 0.0 108.987 -179.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -74.57 -18.92 60.5 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 119.25 -0.405 . . . . 0.0 111.819 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -141.86 151.97 43.2 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 123.715 0.806 . . . . 0.0 110.328 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.65 -33.66 73.13 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -175.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -78.21 -31.06 49.21 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 119.313 0.96 . . . . 0.0 111.061 177.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.0 m -62.81 -39.4 94.18 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 169.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.91 -48.34 80.17 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 124.387 1.075 . . . . 0.0 110.483 171.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.5 mm -58.71 -51.89 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.49 -38.8 95.43 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 118.912 0.778 . . . . 0.0 111.651 -178.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.8 -53.5 39.49 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 124.306 1.042 . . . . 0.0 110.394 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.4 mm -51.17 -48.16 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 C-N-CA 125.663 1.585 . . . . 0.0 108.56 176.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -68.27 -16.09 63.82 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.425 0.69 . . . . 0.0 112.006 -176.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -87.5 -44.83 11.0 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 123.631 0.773 . . . . 0.0 109.613 172.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.403 HD21 HD12 ' A' ' 103' ' ' LEU . 3.8 pp -68.78 -25.77 64.87 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 118.662 0.664 . . . . 0.0 111.316 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 49.1 m -60.79 -21.88 63.53 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 123.759 0.823 . . . . 0.0 112.32 173.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -66.5 -17.68 64.94 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 119.307 0.958 . . . . 0.0 110.299 173.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 36.1 mt -105.95 -58.69 1.88 Allowed 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.382 1.473 . . . . 0.0 109.898 177.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.8 -28.13 65.7 Favored 'General case' 0 N--CA 1.464 0.244 0 N-CA-C 114.433 1.272 . . . . 0.0 114.433 -177.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 42.0 m -108.52 26.73 10.15 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-N 118.912 0.778 . . . . 0.0 110.844 -175.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -132.42 97.51 4.12 Favored 'General case' 0 CA--C 1.517 -0.289 0 C-N-CA 124.679 1.192 . . . . 0.0 108.054 178.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -55.54 -27.46 49.06 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.841 0.856 . . . . 0.0 112.526 -177.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.13 -44.83 87.42 Favored 'General case' 0 C--O 1.232 0.138 0 C-N-CA 123.104 0.562 . . . . 0.0 110.013 176.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -65.62 -44.98 93.51 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 174.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 52.8 mt -53.74 -45.73 70.62 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 118.429 0.559 . . . . 0.0 111.555 -175.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -65.78 -38.55 89.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.435 0.561 . . . . 0.0 110.705 179.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.401 ' HB3' HD11 ' A' ' 143' ' ' ILE . 45.1 mt-30 -70.1 -32.45 70.51 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-N 118.64 0.654 . . . . 0.0 110.11 -177.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 25.6 mt -68.75 -52.97 24.82 Favored 'General case' 0 C--O 1.225 -0.2 0 N-CA-C 108.844 -0.798 . . . . 0.0 108.844 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 55.1 mt -59.17 -13.12 6.37 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -176.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 81.4 p -123.84 10.87 8.97 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.223 1.409 . . . . 0.0 110.898 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.01 119.02 5.58 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 124.624 1.17 . . . . 0.0 109.879 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.5 p -71.95 -16.17 62.09 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.321 1.048 . . . . 0.0 112.307 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 73.4 p -159.38 164.87 34.31 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.571 0.623 . . . . 0.0 111.067 -172.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -62.27 -33.81 75.35 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 169.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -60.36 -37.47 80.8 Favored 'General case' 0 C--N 1.34 0.185 0 O-C-N 121.827 -0.545 . . . . 0.0 111.573 174.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -77.28 -28.54 53.43 Favored 'General case' 0 N--CA 1.431 -1.415 0 CA-C-N 119.703 1.138 . . . . 0.0 110.713 179.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 35.2 mt -65.44 -48.63 72.09 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 120.286 1.403 . . . . 0.0 108.289 169.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.04 -34.1 69.71 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.821 1.248 . . . . 0.0 113.189 174.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -63.17 -42.01 99.33 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 119.066 0.848 . . . . 0.0 110.487 176.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.401 HD11 ' HB3' ' A' ' 130' ' ' GLN . 91.4 mt -68.47 -36.54 75.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 C-N-CA 123.343 0.657 . . . . 0.0 109.527 179.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 22.3 mm -57.85 -52.64 55.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 169.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 28.8 m -64.11 -28.02 69.49 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 122.816 0.446 . . . . 0.0 111.484 -170.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.9 ttm180 -59.64 -28.5 67.28 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.675 1.59 . . . . 0.0 113.396 175.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.911 0 N-CA-C 108.904 -1.679 . . . . 0.0 108.904 -174.452 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 tpt . . . . . 0 N--CA 1.487 1.402 0 N-CA-C 110.234 -0.284 . . . . 0.0 110.234 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -65.98 110.0 2.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 105.508 -2.034 . . . . 0.0 105.508 168.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.51 -45.99 66.46 Favored 'General case' 0 CA--C 1.516 -0.349 0 C-N-CA 123.683 0.793 . . . . 0.0 109.746 -175.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.47 -19.93 6.66 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.279 1.832 . . . . 0.0 113.143 -176.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -62.4 -31.47 72.15 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 119.349 0.977 . . . . 0.0 111.995 175.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -88.3 -22.38 23.92 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.686 -174.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -99.4 100.14 9.9 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 106.424 -1.695 . . . . 0.0 106.424 -173.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.18 -81.13 0.01 OUTLIER 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 123.689 2.926 . . . . 0.0 113.298 -169.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -157.05 161.03 39.49 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 127.43 2.292 . . . . 0.0 105.485 172.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.4 m 59.06 -0.12 0.15 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.568 1.547 . . . . 0.0 113.075 -174.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.1 p -80.05 4.65 16.43 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 128.397 2.679 . . . . 0.0 112.708 -169.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 6.6 mt -133.32 132.04 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 N-CA-C 104.145 -2.539 . . . . 0.0 104.145 -173.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.0 m -156.15 147.4 22.44 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 118.685 0.675 . . . . 0.0 111.066 -179.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 85.3 t -116.67 143.45 26.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 105.722 -1.955 . . . . 0.0 105.722 169.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 4.8 mt -138.7 147.51 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 C-N-CA 126.245 1.818 . . . . 0.0 106.31 -172.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 75.0 t60 -72.47 -47.51 48.18 Favored 'General case' 0 CA--C 1.53 0.186 0 O-C-N 121.594 -0.691 . . . . 0.0 109.713 172.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.2 p -160.67 141.91 12.0 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.073 -1.455 . . . . 0.0 107.073 179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -75.82 155.1 35.71 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 107.74 -1.208 . . . . 0.0 107.74 169.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -56.34 -44.83 80.42 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 123.631 0.772 . . . . 0.0 109.716 177.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -163.58 -176.92 4.93 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.824 2.05 . . . . 0.0 108.242 170.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -64.3 -32.79 74.52 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.485 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 35.0 mt-30 -58.88 -50.52 73.69 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 120.805 1.639 . . . . 0.0 107.206 171.188 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -60.73 -35.22 75.8 Favored 'General case' 0 C--O 1.223 -0.308 0 O-C-N 121.795 -0.566 . . . . 0.0 111.806 177.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.97 -31.94 72.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 121.894 -0.504 . . . . 0.0 110.905 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -67.25 -48.53 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 170.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -55.96 -45.63 78.84 Favored 'General case' 0 C--O 1.225 -0.202 0 CA-C-N 118.23 0.468 . . . . 0.0 110.442 -179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -64.69 -28.91 69.92 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 118.031 -0.985 . . . . 0.0 112.343 174.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.9 m -69.9 -19.95 63.39 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 120.223 1.374 . . . . 0.0 112.224 172.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.2 mmt -123.86 -18.68 5.93 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -168.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 11.2 p -57.03 -37.88 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.196 0 CA-C-N 120.273 1.397 . . . . 0.0 112.591 -169.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.3 m -67.21 -27.7 67.46 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.825 0.738 . . . . 0.0 111.568 -178.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 94.4 mt -77.43 -44.37 29.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.649 0.78 . . . . 0.0 108.986 172.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -56.4 -51.02 69.91 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 124.109 0.964 . . . . 0.0 110.092 -179.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -56.21 -28.59 58.85 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 126.576 1.95 . . . . 0.0 113.757 -176.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -113.71 24.45 12.12 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 123.057 0.543 . . . . 0.0 109.996 -175.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 61.66 20.69 11.54 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 171.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -71.24 -24.18 62.14 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.894 -1.129 . . . . 0.0 111.158 174.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.4 pt -143.88 176.3 2.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 C-N-CA 126.101 1.76 . . . . 0.0 108.929 -178.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.1 m -114.26 160.56 18.9 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.597 1.959 . . . . 0.0 108.203 175.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -59.02 -37.47 76.98 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 119.907 1.231 . . . . 0.0 111.826 -175.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -60.71 -22.54 64.07 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.797 0.839 . . . . 0.0 113.206 175.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -65.25 -45.58 83.98 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 119.798 1.181 . . . . 0.0 109.934 174.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.99 -50.53 79.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 176.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.6 tp60 -69.86 -23.86 63.34 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 117.971 -1.014 . . . . 0.0 111.952 -173.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -59.01 -42.7 90.74 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 120.149 1.341 . . . . 0.0 111.025 172.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.5 mt -70.09 -46.3 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 -179.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.5 mttt -61.64 -40.62 95.55 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -65.13 -38.55 91.01 Favored 'General case' 0 N--CA 1.462 0.146 0 C-N-CA 124.176 0.99 . . . . 0.0 111.445 178.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.9 m -61.72 -42.05 98.43 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.733 -0.604 . . . . 0.0 109.603 171.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 22.6 m -63.33 -35.36 80.11 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.463 -0.773 . . . . 0.0 110.915 177.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 84.6 mt -65.94 -42.39 91.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 119.262 0.937 . . . . 0.0 110.074 172.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -63.64 -34.52 78.02 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.527 0.731 . . . . 0.0 112.545 -169.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -149.83 -44.94 0.13 Allowed 'General case' 0 C--O 1.231 0.121 0 C-N-CA 122.998 0.519 . . . . 0.0 111.918 -169.126 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.23 -179.72 20.52 Favored Glycine 0 CA--C 1.527 0.835 0 N-CA-C 107.887 -2.085 . . . . 0.0 107.887 -169.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -60.98 136.77 67.71 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 121.975 1.783 . . . . 0.0 110.362 -179.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -100.34 -6.67 25.47 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.967 0.907 . . . . 0.0 112.001 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -129.01 78.0 1.83 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 108.153 -1.055 . . . . 0.0 108.153 -169.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 43.6 mm -124.91 136.02 62.15 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 106.527 -1.657 . . . . 0.0 106.527 -179.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -121.97 -31.26 3.94 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 123.651 0.78 . . . . 0.0 110.923 -172.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.77 160.21 30.16 Favored Pre-proline 0 CA--C 1.534 0.351 0 C-N-CA 125.883 1.673 . . . . 0.0 106.708 173.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -49.84 119.91 5.36 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 122.394 2.063 . . . . 0.0 109.979 169.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.9 -6.2 73.07 Favored Glycine 0 CA--C 1.532 1.104 0 CA-C-O 117.843 -1.532 . . . . 0.0 114.465 -179.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.6 t -126.25 117.35 48.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 119.769 1.785 . . . . 0.0 108.339 -170.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -118.76 168.8 10.4 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 124.412 1.085 . . . . 0.0 110.246 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.528 ' CE ' HD11 ' A' ' 118' ' ' LEU . 7.2 ttm -140.69 62.31 17.72 Favored Pre-proline 0 CA--C 1.537 0.48 0 C-N-CA 122.93 0.492 . . . . 0.0 111.99 177.003 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.59 135.64 48.54 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 121.56 1.506 . . . . 0.0 111.83 -179.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER 176.42 157.61 0.27 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 128.28 2.632 . . . . 0.0 106.221 -170.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.13 163.92 30.46 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.207 1.403 . . . . 0.0 108.224 178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.0 mmp_? -58.11 153.91 32.89 Favored Pre-proline 0 N--CA 1.465 0.312 0 CA-C-O 118.818 -0.61 . . . . 0.0 110.104 175.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.3 -39.21 91.56 Favored 'Trans proline' 0 CA--C 1.536 0.62 0 C-N-CA 122.13 1.886 . . . . 0.0 110.446 -172.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -61.86 -15.31 41.27 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.704 1.602 . . . . 0.0 113.055 -178.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 83.7 m -79.11 -8.61 59.12 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 118.513 -0.756 . . . . 0.0 111.656 -179.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 139.02 13.5 0.69 Allowed Glycine 0 C--N 1.339 0.736 0 CA-C-O 117.825 -1.542 . . . . 0.0 114.206 173.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.29 147.49 52.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.854 1.827 . . . . 0.0 109.625 173.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.1 mt -130.6 -35.55 1.48 Allowed 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.309 1.043 . . . . 0.0 110.32 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 44.3 mtmt -148.6 158.34 44.06 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 125.292 1.437 . . . . 0.0 108.542 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 83.4 m -90.29 133.74 34.75 Favored 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 122.988 0.515 . . . . 0.0 111.927 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -177.34 -179.14 47.49 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.923 1.249 . . . . 0.0 111.11 -177.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 24.2 mtm -146.65 169.67 18.53 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 126.241 1.816 . . . . 0.0 110.775 -179.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.0 m -151.04 170.61 18.96 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.473 1.509 . . . . 0.0 109.425 171.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.418 HD22 HD11 ' A' ' 144' ' ' ILE . 28.9 tp -145.78 131.02 18.48 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 127.854 2.461 . . . . 0.0 108.408 -169.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 28.6 m -140.78 137.19 33.18 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -173.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -129.27 141.44 51.11 Favored 'General case' 0 C--O 1.231 0.101 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 172.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 9.7 mp -119.61 126.83 52.12 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 126.398 1.879 . . . . 0.0 106.368 176.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -64.42 -44.73 90.32 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 118.423 0.556 . . . . 0.0 111.251 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 38.1 mm-40 -85.53 -23.54 27.65 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 124.292 1.037 . . . . 0.0 111.667 -178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 73.97 176.18 33.75 Favored Glycine 0 CA--C 1.532 1.145 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -168.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -144.93 160.27 13.93 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 169.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -109.76 101.61 10.48 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.67 0.748 . . . . 0.0 110.543 -168.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 11.0 m-85 -63.54 141.72 97.9 Favored Pre-proline 0 CA--C 1.541 0.633 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.448 169.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -61.17 129.65 29.36 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.116 2.544 . . . . 0.0 112.029 -169.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 68.27 9.63 58.05 Favored Glycine 0 CA--C 1.531 1.057 0 CA-C-O 118.51 -1.161 . . . . 0.0 114.639 172.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -74.69 168.29 20.13 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.581 1.691 . . . . 0.0 111.195 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -61.17 -40.94 95.77 Favored 'General case' 0 N--CA 1.463 0.201 0 O-C-N 121.969 -0.457 . . . . 0.0 111.946 178.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -158.25 164.95 19.66 Favored Pre-proline 0 CA--C 1.542 0.67 0 C-N-CA 124.725 1.21 . . . . 0.0 110.915 178.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -48.98 142.9 18.86 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 123.632 2.888 . . . . 0.0 113.407 169.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 22.9 mm -84.93 136.32 23.01 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.291 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 172.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -111.59 -18.46 12.8 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 117.686 -1.149 . . . . 0.0 110.625 170.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 131' ' ' LEU . 15.3 tp -140.4 135.56 32.21 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-N 120.001 1.273 . . . . 0.0 109.818 -173.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.3 mp -138.6 138.37 37.84 Favored 'General case' 0 C--O 1.233 0.217 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 -174.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 2.1 mt -115.24 128.93 72.24 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 168.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -88.28 149.95 21.66 Favored Glycine 0 CA--C 1.522 0.502 0 N-CA-C 108.592 -1.803 . . . . 0.0 108.592 170.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 104' ' ' SER . 0.5 OUTLIER -148.6 144.82 27.48 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 172.846 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.541 ' N ' HD23 ' A' ' 103' ' ' LEU . 77.9 p -142.48 145.95 34.25 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 106.43 -1.693 . . . . 0.0 106.43 168.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.474 ' HB3' ' CG ' ' A' ' 111' ' ' HIS . . . -145.96 145.85 30.81 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 118.553 0.615 . . . . 0.0 109.706 171.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.89 -16.94 59.96 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.477 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -137.61 155.8 48.78 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.362 0.665 . . . . 0.0 110.746 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -62.37 -38.62 90.27 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.342 0.657 . . . . 0.0 112.472 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -73.05 -31.1 64.2 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.211 -0.93 . . . . 0.0 110.837 178.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 20.3 m -64.36 -37.99 89.44 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 119.01 -0.519 . . . . 0.0 110.289 169.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.474 ' CG ' ' HB3' ' A' ' 105' ' ' ALA . 24.0 m80 -62.23 -44.64 96.1 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.779 171.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.6 -51.28 60.02 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.272 0 CA-C-N 119.141 0.882 . . . . 0.0 108.874 177.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.59 -40.72 96.74 Favored Glycine 0 CA--C 1.531 1.063 0 CA-C-N 119.063 0.847 . . . . 0.0 111.916 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.42 -46.15 70.7 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.617 0.767 . . . . 0.0 111.096 -179.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 5.0 mm -58.91 -46.12 91.47 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 C-N-CA 125.201 1.4 . . . . 0.0 108.168 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.1 mm-40 -69.02 -9.97 55.18 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 121.135 -0.978 . . . . 0.0 111.623 -178.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.41 -50.63 5.54 Favored 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 123.929 0.892 . . . . 0.0 108.93 172.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.528 HD11 ' CE ' ' A' ' 65' ' ' MET . 3.9 pp -68.52 -27.34 66.02 Favored 'General case' 0 N--CA 1.45 -0.474 0 O-C-N 121.773 -0.579 . . . . 0.0 111.646 -176.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.4 m -62.42 -20.98 65.04 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.318 0.508 . . . . 0.0 112.062 175.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -64.16 -19.12 65.08 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 119.283 0.947 . . . . 0.0 110.096 171.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 33.4 mt -108.12 -60.54 1.71 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.022 1.729 . . . . 0.0 110.941 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 6.4 mt -65.75 -18.13 65.11 Favored 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -175.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.6 m -111.39 26.84 10.25 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.268 0.94 . . . . 0.0 110.887 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -139.54 97.47 3.28 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -172.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -55.83 -27.39 51.24 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.789 0.836 . . . . 0.0 112.418 -175.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -61.95 -45.08 95.22 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 122.875 0.47 . . . . 0.0 110.125 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.5 mp -71.69 -45.04 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 123.662 0.785 . . . . 0.0 108.887 176.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 68.0 mt -55.69 -41.67 74.06 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 118.85 -0.595 . . . . 0.0 111.026 -172.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -70.83 -33.98 71.22 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 118.435 0.561 . . . . 0.0 110.327 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -66.13 -41.65 90.22 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.222 0.919 . . . . 0.0 108.764 179.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.465 HD13 HD21 ' A' ' 99' ' ' LEU . 21.4 mt -69.02 -48.08 63.86 Favored 'General case' 0 CA--C 1.518 -0.256 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 178.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 64.1 mt -62.66 -5.9 3.1 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 178.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 73.8 p -122.6 11.73 9.89 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.346 1.458 . . . . 0.0 110.923 175.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.17 110.09 2.07 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 124.378 1.071 . . . . 0.0 109.974 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -73.99 -14.71 61.07 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.782 0.833 . . . . 0.0 112.303 178.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 82.1 p -151.73 163.74 38.48 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 118.943 0.792 . . . . 0.0 110.866 -174.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -56.74 -39.67 74.4 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 124.523 1.129 . . . . 0.0 109.671 169.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -59.93 -40.01 87.47 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 123.27 0.628 . . . . 0.0 110.84 177.83 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -65.85 -38.76 89.73 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 118.865 0.757 . . . . 0.0 112.261 177.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.3 mt -62.79 -48.24 79.98 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.637 1.108 . . . . 0.0 108.517 176.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -57.74 -37.19 73.17 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.561 1.145 . . . . 0.0 113.66 174.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -62.83 -39.72 95.21 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 121.187 -0.946 . . . . 0.0 110.099 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 49.9 mt -71.93 -35.76 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.615 0 C-N-CA 123.718 0.807 . . . . 0.0 110.206 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . 0.418 HD11 HD22 ' A' ' 81' ' ' LEU . 17.1 mm -57.01 -46.28 84.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 118.835 0.743 . . . . 0.0 109.776 169.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 43.8 m -65.02 -22.53 67.01 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 -169.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.482 ' HG2' HH11 ' A' ' 146' ' ' ARG . 6.1 mtt-85 -68.11 -35.72 78.59 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.978 0.808 . . . . 0.0 111.509 176.595 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.154 0 CA-C-O 117.779 -1.567 . . . . 0.0 110.834 -168.764 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.759 0.314 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -65.44 115.18 5.42 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -53.67 -45.33 70.25 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.466 1.104 . . . . 0.0 108.457 -179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.42 -27.1 5.83 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 126.519 1.928 . . . . 0.0 113.34 -179.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -60.52 -28.38 68.36 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.947 0.794 . . . . 0.0 112.539 178.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -93.09 -14.68 26.97 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.03 0.932 . . . . 0.0 113.085 -173.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -102.65 114.43 65.33 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 120.561 1.528 . . . . 0.0 108.589 -173.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -61.82 -76.78 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.436 2.757 . . . . 0.0 113.46 -176.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.401 ' C ' ' H ' ' A' ' 11' ' ' SER . 7.7 tp10 -162.52 -68.84 0.05 Allowed 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.432 1.093 . . . . 0.0 110.957 -178.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -67.32 4.53 0.95 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.923 1.289 . . . . 0.0 112.077 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.401 ' H ' ' C ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -70.51 -8.73 53.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.534 1.934 . . . . 0.0 113.056 -170.742 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.9 mt -120.52 125.5 74.2 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.9 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 -169.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.6 m -145.27 149.58 35.11 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.321 0.581 . . . . 0.0 111.219 -175.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.5 t -126.25 138.49 54.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 170.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.1 mt -139.25 150.45 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.384 0 N-CA-C 106.291 -1.744 . . . . 0.0 106.291 -174.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -70.19 -46.69 64.07 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.699 -0.625 . . . . 0.0 110.282 177.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.1 p -164.15 146.66 9.15 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.604 ' HB3' HG21 ' A' ' 88' ' ' VAL . . . -76.89 160.98 28.77 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 172.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.6 tmmt? -57.48 -43.39 84.04 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.07 0.548 . . . . 0.0 110.417 173.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -168.35 178.86 4.69 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 127.038 2.135 . . . . 0.0 108.342 174.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -61.81 -34.33 75.74 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 125.807 1.643 . . . . 0.0 113.045 -179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.436 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 53.9 mm-40 -62.03 -50.93 70.03 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.663 1.574 . . . . 0.0 107.834 169.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -60.25 -35.44 75.5 Favored 'General case' 0 C--O 1.223 -0.317 0 O-C-N 121.836 -0.54 . . . . 0.0 111.705 -179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.1 -31.89 73.14 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.555 0.742 . . . . 0.0 110.751 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -71.16 -46.71 64.81 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 173.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -56.93 -45.86 82.45 Favored 'General case' 0 C--O 1.226 -0.18 0 O-C-N 121.656 -0.653 . . . . 0.0 110.517 178.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -64.1 -30.33 71.41 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.375 -0.821 . . . . 0.0 111.894 174.612 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 m -67.45 -27.29 66.91 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 119.587 1.085 . . . . 0.0 112.173 173.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 2.2 mmm -119.79 -13.54 9.09 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.087 1.312 . . . . 0.0 114.425 -169.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.6 p -58.21 -39.13 72.17 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.349 0 CA-C-N 120.792 1.633 . . . . 0.0 112.723 -169.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.0 m -66.11 -22.78 66.41 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 119.017 0.826 . . . . 0.0 111.908 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.7 mt -82.55 -43.05 17.58 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.061 0.944 . . . . 0.0 108.925 174.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -55.82 -49.96 71.83 Favored 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 124.094 0.958 . . . . 0.0 109.737 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.58 -30.6 61.13 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 126.212 1.805 . . . . 0.0 113.947 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.8 mttm -111.27 22.66 14.94 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.35 -175.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 57.74 25.42 11.83 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.463 -0.79 . . . . 0.0 113.054 173.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -69.12 -25.72 64.54 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.279 -0.888 . . . . 0.0 110.368 169.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 39.3 pt -144.47 176.54 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 125.759 1.623 . . . . 0.0 109.288 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.5 m -116.61 159.1 22.66 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 126.7 2.0 . . . . 0.0 108.04 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -58.56 -33.44 69.92 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.651 1.114 . . . . 0.0 113.22 -173.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -57.02 -32.23 65.94 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.169 0.587 . . . . 0.0 111.775 175.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -60.23 -45.77 92.09 Favored 'General case' 0 N--CA 1.457 -0.12 0 C-N-CA 123.366 0.666 . . . . 0.0 110.421 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.31 -49.32 83.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 176.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.1 tp60 -69.6 -24.54 63.68 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.17 -0.919 . . . . 0.0 112.219 -177.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.47 -44.42 94.46 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 120.084 1.311 . . . . 0.0 110.488 174.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 56.1 mt -67.04 -47.04 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 178.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 88.5 mttt -58.67 -43.91 90.05 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 117.89 0.314 . . . . 0.0 110.781 -178.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -67.41 -39.87 85.54 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 124.272 1.029 . . . . 0.0 110.934 -178.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.6 m -62.14 -40.59 96.45 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.281 0.562 . . . . 0.0 110.223 173.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 40.4 m -65.35 -36.63 84.59 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.01 0.924 . . . . 0.0 110.917 177.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 72.3 mt -68.17 -41.86 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 119.135 0.879 . . . . 0.0 109.844 172.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -64.37 -37.28 86.96 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 123.9 0.88 . . . . 0.0 112.433 -170.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -146.06 -46.11 0.2 Allowed 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 123.69 0.796 . . . . 0.0 110.828 -168.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.28 173.78 15.1 Favored Glycine 0 CA--C 1.525 0.687 0 N-CA-C 109.444 -1.463 . . . . 0.0 109.444 -175.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_exo -44.52 126.8 7.21 Favored 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 123.99 3.127 . . . . 0.0 112.395 172.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -88.74 -11.44 45.05 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.978 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -135.27 98.0 3.86 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -169.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 23.8 mm -141.19 139.13 33.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 -175.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.9 mp -132.09 -25.8 1.98 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -170.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.13 161.43 25.85 Favored Pre-proline 0 C--O 1.237 0.401 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 176.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_exo -49.63 116.38 2.31 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.487 2.125 . . . . 0.0 111.005 172.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 90.55 4.92 69.84 Favored Glycine 0 CA--C 1.53 1.027 0 CA-C-O 118.152 -1.36 . . . . 0.0 114.501 177.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 57.6 t -129.5 122.69 55.97 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 CA-C-N 119.33 1.565 . . . . 0.0 108.81 -169.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -121.09 166.03 14.49 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.297 1.439 . . . . 0.0 110.122 177.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 24.7 ttm -136.41 63.88 50.22 Favored Pre-proline 0 CA--C 1.542 0.663 0 CA-C-O 118.912 -0.566 . . . . 0.0 111.73 173.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -51.52 147.57 22.68 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.18 1.92 . . . . 0.0 113.865 -173.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 174.07 154.92 0.12 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.535 2.334 . . . . 0.0 107.329 -169.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.66 151.7 50.47 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 106.657 -1.609 . . . . 0.0 106.657 169.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -53.6 141.86 43.62 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-O 117.429 -1.272 . . . . 0.0 109.265 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_exo -43.67 -44.46 11.24 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 124.24 3.293 . . . . 0.0 114.645 -170.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -63.73 -9.23 13.18 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.689 1.196 . . . . 0.0 114.023 -177.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 61.7 m -76.63 -1.66 28.8 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.128 0.971 . . . . 0.0 111.867 175.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 129.09 13.48 2.4 Favored Glycine 0 C--N 1.336 0.577 0 CA-C-O 118.185 -1.341 . . . . 0.0 112.985 172.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.4 148.26 52.02 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 119.342 1.571 . . . . 0.0 109.278 170.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 86.2 mt -133.04 -31.05 1.3 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 124.751 1.22 . . . . 0.0 110.975 -173.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 46.4 mttm -143.91 166.84 23.81 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 126.057 1.743 . . . . 0.0 107.042 178.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 90.2 m -101.93 125.91 48.71 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 123.17 0.588 . . . . 0.0 109.734 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -174.28 175.76 46.67 Favored Glycine 0 CA--C 1.532 1.119 0 C-N-CA 124.714 1.149 . . . . 0.0 111.276 -177.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.7 ' SD ' HD21 ' A' ' 118' ' ' LEU . 56.8 mtt -140.72 167.71 21.53 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 124.803 1.241 . . . . 0.0 112.246 -170.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.9 p -144.25 165.33 28.18 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.136 1.774 . . . . 0.0 109.377 178.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.489 HD22 HD11 ' A' ' 144' ' ' ILE . 34.0 tp -146.92 110.81 5.01 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.191 1.797 . . . . 0.0 107.861 -169.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 31.5 m -127.02 139.35 53.08 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 -171.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 12.1 tp -135.22 145.35 47.56 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 174.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -125.01 112.35 16.46 Favored 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 126.161 1.785 . . . . 0.0 106.193 -173.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -59.83 -24.79 64.47 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -176.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 13.1 mm-40 -116.79 -5.32 11.56 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.192 0.997 . . . . 0.0 112.088 -177.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.95 168.58 4.43 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.628 1.109 . . . . 0.0 113.49 -173.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.604 HG21 ' HB3' ' A' ' 18' ' ' ALA . 16.3 t -139.11 148.99 23.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 N-CA-C 105.137 -2.172 . . . . 0.0 105.137 174.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -116.42 100.62 8.0 Favored 'General case' 0 C--N 1.334 -0.093 0 O-C-N 121.762 -0.586 . . . . 0.0 110.712 -168.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -59.11 150.99 59.41 Favored Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.679 173.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -75.62 -0.58 10.32 Favored 'Trans proline' 0 CA--C 1.541 0.874 0 C-N-CA 123.455 2.77 . . . . 0.0 115.119 -172.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -149.05 35.78 1.06 Allowed Glycine 0 CA--C 1.526 0.735 0 CA-C-N 119.659 1.118 . . . . 0.0 113.02 -171.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 44.3 t30 -131.82 161.11 33.73 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 118.029 0.914 . . . . 0.0 108.559 172.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -72.91 -21.79 60.84 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -171.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -149.51 164.86 19.23 Favored Pre-proline 0 CA--C 1.546 0.794 0 C-N-CA 124.105 0.962 . . . . 0.0 111.699 -176.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -74.39 150.26 41.05 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.835 2.356 . . . . 0.0 110.714 177.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 40.7 mm -99.53 136.91 28.71 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.386 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 -177.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -109.72 -14.24 14.36 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 117.161 -1.4 . . . . 0.0 111.096 172.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.511 HD21 HD13 ' A' ' 131' ' ' LEU . 37.3 tp -144.11 131.9 21.36 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-N 120.603 1.547 . . . . 0.0 110.319 -169.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.9 mp -138.71 117.2 12.07 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 -174.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.735 HG21 HD22 ' A' ' 118' ' ' LEU . 1.4 mp -98.39 111.02 27.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 105.141 -2.17 . . . . 0.0 105.141 173.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.07 151.39 36.91 Favored Glycine 0 CA--C 1.527 0.817 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 174.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.436 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -143.26 142.93 31.53 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 105.408 -2.071 . . . . 0.0 105.408 172.05 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.436 ' N ' HD23 ' A' ' 103' ' ' LEU . 27.4 p -135.68 144.24 45.87 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 127.248 2.219 . . . . 0.0 106.498 169.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -146.8 135.94 22.57 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 -175.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -77.98 -22.41 49.43 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.723 0.409 . . . . 0.0 111.803 -177.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -144.05 155.67 44.08 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 124.011 0.924 . . . . 0.0 110.019 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.09 -34.99 74.23 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -177.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -75.97 -32.11 59.33 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.865 -1.147 . . . . 0.0 110.937 177.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 12.9 m -62.51 -41.12 98.61 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 169.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 23.4 t60 -58.27 -49.93 75.4 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.027 0.931 . . . . 0.0 110.038 173.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.6 mm -55.94 -54.19 29.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 118.875 0.761 . . . . 0.0 109.568 179.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -60.06 -38.77 94.79 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.669 0.668 . . . . 0.0 111.702 -176.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.56 -48.49 60.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.466 1.107 . . . . 0.0 111.1 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.3 mm -56.32 -43.55 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 124.489 1.115 . . . . 0.0 108.758 176.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -70.47 -11.11 60.71 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.716 0.806 . . . . 0.0 111.991 -178.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -84.88 -45.32 12.37 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 169.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.735 HD22 HG21 ' A' ' 101' ' ' ILE . 95.8 mt -71.13 -30.29 66.31 Favored 'General case' 0 CA--C 1.515 -0.396 0 O-C-N 121.742 -0.599 . . . . 0.0 112.042 -173.668 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.1 m -61.44 -21.1 63.83 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 122.98 0.512 . . . . 0.0 112.076 172.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -68.7 -28.18 66.61 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.608 1.094 . . . . 0.0 110.0 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 40.0 mt -96.66 -63.6 1.12 Allowed 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.0 0.92 . . . . 0.0 111.037 -178.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.41 ' HA ' HD21 ' A' ' 128' ' ' LEU . 17.2 mt -73.38 -1.13 16.9 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -169.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 55.6 m -112.04 27.83 9.3 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 119.529 1.059 . . . . 0.0 111.357 174.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -141.33 97.66 3.21 Favored 'General case' 0 N--CA 1.444 -0.739 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 -171.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.87 -26.16 58.15 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.658 0.783 . . . . 0.0 112.371 -173.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -63.43 -46.3 86.95 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 121.224 0.535 . . . . 0.0 109.79 176.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.54 -43.79 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.406 0 C-N-CA 124.427 1.091 . . . . 0.0 109.134 176.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 122' ' ' LEU . 46.8 mt -56.52 -44.58 80.92 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 118.945 -0.55 . . . . 0.0 110.976 -173.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -67.04 -38.54 86.07 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 118.152 0.433 . . . . 0.0 110.367 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.402 ' HB3' HD11 ' A' ' 143' ' ' ILE . 49.2 mt-30 -67.64 -35.86 79.69 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 118.723 0.692 . . . . 0.0 109.696 -177.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.511 HD13 HD21 ' A' ' 99' ' ' LEU . 26.2 mt -70.06 -51.98 27.62 Favored 'General case' 0 C--N 1.341 0.227 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 173.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 57.4 mt -60.54 -12.03 8.75 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -176.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 80.7 p -120.39 8.09 10.75 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.844 1.258 . . . . 0.0 111.321 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.49 114.67 3.08 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.591 1.156 . . . . 0.0 109.782 177.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 15.8 m -75.5 -20.26 58.87 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.857 0.863 . . . . 0.0 111.865 178.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 16.3 m -147.79 157.55 43.59 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 123.976 0.91 . . . . 0.0 109.939 -169.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -61.01 -38.62 86.72 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.434 1.093 . . . . 0.0 110.522 -179.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.1 mmtm -58.61 -36.63 74.32 Favored 'General case' 0 C--O 1.226 -0.178 0 O-C-N 121.946 -0.471 . . . . 0.0 111.389 175.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -68.87 -34.14 74.94 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 123.727 0.811 . . . . 0.0 112.074 177.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.425 ' HB3' HD21 ' A' ' 81' ' ' LEU . 58.6 mt -67.28 -45.46 76.53 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 119.733 1.151 . . . . 0.0 107.954 172.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -64.65 -27.08 68.68 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -61.55 -38.84 88.94 Favored 'General case' 0 C--N 1.33 -0.239 0 O-C-N 120.776 -1.203 . . . . 0.0 109.914 174.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.402 HD11 ' HB3' ' A' ' 130' ' ' GLN . 80.1 mt -72.37 -34.99 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 124.514 1.125 . . . . 0.0 109.221 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . 0.489 HD11 HD22 ' A' ' 81' ' ' LEU . 36.3 mm -56.45 -51.76 60.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 169.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.6 m -65.57 -29.59 70.22 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.987 -170.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.9 ttm-85 -61.51 -30.15 70.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.495 1.918 . . . . 0.0 112.569 172.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.006 0 CA-C-O 117.931 -1.483 . . . . 0.0 110.435 -172.357 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.6 ttt . . . . . 0 N--CA 1.486 1.344 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.14 112.78 1.3 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 120.889 0.376 . . . . 0.0 111.792 171.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.2 -34.38 68.46 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 123.359 0.664 . . . . 0.0 109.876 169.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.1 p -59.9 -12.29 7.37 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.189 1.396 . . . . 0.0 113.166 176.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -87.09 -32.22 20.05 Favored 'General case' 0 C--N 1.342 0.258 0 CA-C-N 119.618 1.099 . . . . 0.0 112.957 171.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -86.35 -43.81 12.58 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 122.794 0.438 . . . . 0.0 110.413 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.425 ' CD1' HG21 ' A' ' 144' ' ' ILE . 0.0 OUTLIER -86.66 119.25 71.2 Favored Pre-proline 0 CA--C 1.551 1.013 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 -178.06 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -82.66 -97.72 0.0 OUTLIER 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 123.866 3.044 . . . . 0.0 112.225 -169.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -151.66 163.27 39.48 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.836 2.054 . . . . 0.0 106.756 173.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m 57.37 14.51 2.21 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.7 1.6 . . . . 0.0 112.226 -169.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.2 p -103.27 19.99 18.58 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.535 2.334 . . . . 0.0 112.354 -168.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.8 mt -133.74 141.35 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 169.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.8 m -156.93 149.45 23.34 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 169.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 86.7 t -113.48 133.56 59.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 103.793 -2.669 . . . . 0.0 103.793 169.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.2 mt -131.67 147.68 32.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -169.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -67.81 -44.64 76.82 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.814 -0.554 . . . . 0.0 110.604 177.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.7 m -165.47 148.55 7.95 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 -176.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.71 148.56 34.88 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 171.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.34 -37.48 83.47 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.109 0.564 . . . . 0.0 110.703 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -164.05 -179.21 6.06 Favored 'General case' 0 C--O 1.233 0.191 0 C-N-CA 127.078 2.151 . . . . 0.0 106.805 174.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 39.4 p-90 -66.48 -33.81 76.52 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 121.584 -0.698 . . . . 0.0 111.812 175.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.468 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 49.2 mt-30 -54.52 -51.08 66.29 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 169.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.37 -31.78 72.77 Favored 'General case' 0 C--O 1.222 -0.382 0 O-C-N 121.842 -0.536 . . . . 0.0 111.411 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.8 87.55 Favored 'General case' 0 N--CA 1.448 -0.526 0 O-C-N 121.853 -0.529 . . . . 0.0 109.812 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.4 -45.68 88.73 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 169.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -57.92 -45.59 86.31 Favored 'General case' 0 N--CA 1.456 -0.134 0 C-N-CA 122.981 0.512 . . . . 0.0 110.423 -174.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -66.68 -32.26 73.46 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 117.778 -1.106 . . . . 0.0 111.815 173.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.3 m -61.42 -24.89 66.84 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 120.023 1.283 . . . . 0.0 111.675 173.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 9.3 mmt -120.13 -19.81 7.62 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.922 1.453 . . . . 0.0 114.922 -169.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.8 p -61.03 -34.15 58.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.485 0 CA-C-N 121.571 1.987 . . . . 0.0 112.212 -171.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 20.4 m -64.78 -30.11 71.11 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 119.245 0.929 . . . . 0.0 111.354 178.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 83.2 mt -74.57 -44.26 51.74 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 123.97 0.908 . . . . 0.0 108.584 172.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 26.4 tp -56.76 -40.17 75.34 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.881 0.872 . . . . 0.0 110.96 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -66.64 -30.59 70.89 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.116 1.367 . . . . 0.0 113.049 -173.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.5 mmtt -98.81 14.71 27.86 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.001 0.364 . . . . 0.0 110.764 172.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.454 0.0 OUTLIER 44.9 43.62 7.22 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 127.183 2.193 . . . . 0.0 115.357 -169.636 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.478 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 30.6 m-85 -66.44 -19.75 65.88 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 121.509 -0.745 . . . . 0.0 109.489 168.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 37.1 pt -143.91 171.2 8.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 C-N-CA 127.152 2.181 . . . . 0.0 108.585 -176.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.0 m -103.78 159.22 15.82 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.065 1.746 . . . . 0.0 107.52 169.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -59.87 -32.44 70.71 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.113 -0.992 . . . . 0.0 111.623 -179.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.2 t30 -57.51 -34.96 69.65 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.12 0.568 . . . . 0.0 112.0 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -59.78 -40.84 89.61 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 123.72 0.808 . . . . 0.0 110.643 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.408 HG22 ' HE3' ' A' ' 47' ' ' LYS . 13.2 mt -63.73 -49.88 80.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 C-N-CA 124.426 1.09 . . . . 0.0 108.599 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -66.14 -28.5 68.84 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 118.59 -0.719 . . . . 0.0 112.479 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.19 -43.16 78.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 118.82 0.736 . . . . 0.0 110.684 173.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 52.2 mt -69.26 -47.16 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.468 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.6 mttt -62.43 -43.87 97.78 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.373 0.533 . . . . 0.0 111.051 -173.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -66.61 -40.85 89.03 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 124.237 1.015 . . . . 0.0 110.757 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.443 ' HB3' ' CE1' ' A' ' 56' ' ' TYR . 18.3 m -63.98 -34.5 78.12 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.938 -0.476 . . . . 0.0 110.415 174.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 92.3 m -65.13 -39.77 93.51 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.752 0.821 . . . . 0.0 110.805 175.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 97.9 mt -63.48 -43.96 98.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 119.35 0.977 . . . . 0.0 109.82 171.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -66.26 -32.93 74.65 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -169.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -145.4 -53.8 0.29 Allowed 'General case' 0 C--O 1.231 0.123 0 O-C-N 123.251 0.344 . . . . 0.0 111.857 -168.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 158.42 170.15 22.75 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -178.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -56.42 133.06 55.67 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.841 2.361 . . . . 0.0 112.857 -170.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.443 ' CE1' ' HB3' ' A' ' 49' ' ' SER . 7.6 m-85 -86.99 85.88 7.28 Favored 'General case' 0 N--CA 1.441 -0.923 0 CA-C-N 113.97 -1.468 . . . . 0.0 107.391 -176.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 110.44 106.09 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 131.43 3.892 . . . . 0.0 111.163 168.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 49.1 mm -127.13 137.29 58.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 172.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -121.54 -31.17 4.08 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 123.309 0.644 . . . . 0.0 111.55 -170.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -159.56 160.1 27.95 Favored Pre-proline 0 C--O 1.236 0.343 0 C-N-CA 125.443 1.497 . . . . 0.0 107.046 176.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -50.92 113.31 1.03 Allowed 'Trans proline' 0 N--CA 1.457 -0.658 0 C-N-CA 122.53 2.153 . . . . 0.0 109.66 169.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 101.52 -6.19 55.2 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-O 117.528 -1.707 . . . . 0.0 114.538 179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.4 t -130.45 127.49 62.57 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 120.036 1.918 . . . . 0.0 110.051 -169.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.62 166.33 16.91 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 126.214 1.805 . . . . 0.0 109.899 176.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.405 ' CE ' HD11 ' A' ' 118' ' ' LEU . 2.0 ttm -140.53 60.33 13.64 Favored Pre-proline 0 CA--C 1.544 0.724 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 176.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -53.09 141.0 59.21 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.824 1.683 . . . . 0.0 113.755 -171.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 8.9 t-80 -177.02 153.88 1.03 Allowed 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 128.537 2.735 . . . . 0.0 106.176 -170.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.82 160.52 38.3 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 126.41 1.884 . . . . 0.0 107.46 172.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.3 mtm105 -55.32 143.89 53.92 Favored Pre-proline 0 CA--C 1.535 0.398 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.838 177.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -45.94 -41.36 20.56 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.721 2.947 . . . . 0.0 113.335 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -61.77 -13.53 24.39 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.052 1.341 . . . . 0.0 113.288 -176.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 62.6 m -76.3 -3.99 39.69 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.463 0.705 . . . . 0.0 111.785 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 126.92 18.19 2.16 Favored Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.236 -1.313 . . . . 0.0 112.941 175.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.55 147.1 53.97 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 119.529 1.665 . . . . 0.0 109.107 169.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.4 mt -129.71 -29.74 2.12 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 124.356 1.062 . . . . 0.0 111.045 -173.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.478 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 87.9 mttt -143.58 157.78 44.16 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 125.707 1.603 . . . . 0.0 107.739 175.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 89.7 m -88.84 126.09 35.21 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.79 -178.4 39.79 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.019 0.819 . . . . 0.0 111.793 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 50.2 mtp -143.77 169.22 18.18 Favored 'General case' 0 N--CA 1.463 0.193 0 C-N-CA 125.37 1.468 . . . . 0.0 111.132 -176.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 73.1 m -155.61 162.96 40.53 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.861 1.264 . . . . 0.0 109.444 169.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 6.7 mp -124.92 136.45 53.78 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 128.108 2.563 . . . . 0.0 107.141 -177.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 88.0 m -134.28 136.29 43.45 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 107.132 -1.433 . . . . 0.0 107.132 175.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.2 tp -129.06 144.59 51.24 Favored 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 123.346 0.404 . . . . 0.0 110.248 171.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -114.24 143.48 44.77 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.139 1.375 . . . . 0.0 109.735 174.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -74.95 -33.31 61.92 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 168.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -125.43 94.91 4.28 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 126.567 1.947 . . . . 0.0 107.324 174.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -56.81 162.35 7.06 Favored Glycine 0 CA--C 1.527 0.788 0 C-N-CA 124.188 0.899 . . . . 0.0 112.589 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 92.7 t -130.78 145.99 34.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 N-CA-C 107.208 -1.404 . . . . 0.0 107.208 -173.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.8 p90 -105.21 172.27 6.88 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.733 0.813 . . . . 0.0 109.374 -174.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -124.19 157.18 65.08 Favored Pre-proline 0 CA--C 1.535 0.379 0 C-N-CA 124.718 1.207 . . . . 0.0 113.202 -169.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -63.12 -4.89 6.93 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.668 2.912 . . . . 0.0 115.441 -176.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -135.8 16.61 3.99 Favored Glycine 0 CA--C 1.532 1.151 0 CA-C-N 119.418 1.008 . . . . 0.0 113.238 174.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -153.94 109.74 3.23 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 119.199 1.499 . . . . 0.0 107.856 172.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -73.8 -22.28 59.86 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -171.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 34.4 tp10 -76.44 127.02 85.54 Favored Pre-proline 0 N--CA 1.437 -1.123 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 178.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -71.8 149.84 54.82 Favored 'Trans proline' 0 N--CA 1.449 -1.137 0 C-N-CA 122.257 1.971 . . . . 0.0 110.58 -179.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 39.9 mm -105.36 123.85 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 41.1 mtpt -91.08 -22.63 20.63 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-O 117.291 -1.337 . . . . 0.0 111.043 170.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 40.7 tp -132.07 128.7 38.77 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 120.293 1.406 . . . . 0.0 110.649 -169.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.4 mp -132.02 138.05 48.07 Favored 'General case' 0 CA--C 1.517 -0.325 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 -178.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 6.0 mt -123.43 107.53 19.21 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.235 0 N-CA-C 106.836 -1.542 . . . . 0.0 106.836 176.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -71.23 147.99 43.47 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 174.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.414 HD12 HD21 ' A' ' 118' ' ' LEU . 0.2 OUTLIER -144.57 135.45 24.93 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 104.762 -2.31 . . . . 0.0 104.762 169.75 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.9 p -129.4 148.28 51.3 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 125.751 1.62 . . . . 0.0 106.793 168.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.84 133.24 21.85 Favored 'General case' 0 CA--C 1.513 -0.476 0 CA-C-N 118.88 0.764 . . . . 0.0 109.568 -177.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -72.71 -20.09 61.28 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 122.892 0.477 . . . . 0.0 111.878 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -147.58 152.62 38.25 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.381 1.072 . . . . 0.0 109.364 178.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.86 -32.87 71.09 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -175.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -77.9 -30.45 50.7 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 119.416 1.007 . . . . 0.0 111.32 178.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 7.9 m -64.76 -37.17 86.7 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.739 -0.6 . . . . 0.0 109.983 169.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -47.07 86.55 Favored 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 124.063 0.945 . . . . 0.0 110.185 170.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 21.5 mm -58.37 -49.45 81.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 178.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -57.39 -41.68 93.31 Favored Glycine 0 CA--C 1.532 1.103 0 CA-C-N 118.97 0.805 . . . . 0.0 111.924 179.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.28 -45.67 65.86 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.524 0.73 . . . . 0.0 111.213 -179.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.0 mm -55.08 -46.71 77.51 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 C-N-CA 124.86 1.264 . . . . 0.0 108.02 174.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -68.41 -9.87 51.35 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.422 1.089 . . . . 0.0 112.348 -177.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -95.95 -43.22 7.91 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 124.593 1.157 . . . . 0.0 110.834 171.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.414 HD21 HD12 ' A' ' 103' ' ' LEU . 4.4 pp -76.05 -26.62 56.73 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 118.376 0.534 . . . . 0.0 111.407 -175.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.6 p -59.4 -21.98 60.73 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.089 173.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -65.61 -20.4 66.3 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 119.137 0.881 . . . . 0.0 110.182 172.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 23.1 mt -102.2 -60.86 1.47 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.319 1.447 . . . . 0.0 111.037 176.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.79 -31.9 68.83 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.986 1.314 . . . . 0.0 113.802 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 59.6 m -104.58 26.74 8.67 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 118.641 0.655 . . . . 0.0 110.74 -174.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -132.29 97.9 4.25 Favored 'General case' 0 CA--C 1.516 -0.336 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 178.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.0 -28.11 55.77 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.572 0.749 . . . . 0.0 112.263 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -65.61 -44.02 87.85 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.07 0.548 . . . . 0.0 110.142 176.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -67.64 -42.54 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 C-N-CA 123.595 0.758 . . . . 0.0 108.998 175.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 62.2 mt -55.24 -43.87 74.98 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-O 118.711 -0.662 . . . . 0.0 110.595 -177.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -65.96 -40.8 91.62 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 118.605 0.639 . . . . 0.0 110.787 178.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.497 ' HB3' HD11 ' A' ' 143' ' ' ILE . 47.6 mt-30 -69.97 -29.0 66.0 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 118.504 0.593 . . . . 0.0 110.877 -175.415 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 34.5 mt -75.77 -52.73 9.78 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.942 0.897 . . . . 0.0 109.195 169.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 38.5 mt -57.61 -20.66 34.35 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.97 0.908 . . . . 0.0 113.294 -176.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 76.4 p -114.25 10.85 17.3 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.679 1.192 . . . . 0.0 111.249 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.98 110.92 1.48 Allowed 'General case' 0 C--N 1.344 0.35 0 C-N-CA 124.167 0.987 . . . . 0.0 110.287 -179.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 10.5 m -74.67 -10.84 59.91 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.567 0.747 . . . . 0.0 112.157 179.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 3.6 p -158.1 152.64 24.72 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 118.997 0.817 . . . . 0.0 108.997 -172.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -59.26 -34.96 72.87 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.634 1.174 . . . . 0.0 110.774 -177.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -35.21 60.15 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 124.561 1.144 . . . . 0.0 113.819 176.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.3 tp60 -73.14 -34.92 66.38 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 123.447 0.699 . . . . 0.0 110.173 -177.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 2.4 mp -61.9 -46.31 89.93 Favored 'General case' 0 C--N 1.344 0.342 0 CA-C-N 119.978 1.263 . . . . 0.0 109.019 172.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.71 -29.93 71.03 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.479 0.712 . . . . 0.0 112.637 177.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -68.63 -44.85 73.35 Favored 'General case' 0 C--N 1.332 -0.163 0 O-C-N 121.169 -0.957 . . . . 0.0 110.421 174.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.497 HD11 ' HB3' ' A' ' 130' ' ' GLN . 68.8 mt -62.34 -38.58 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 C-N-CA 124.229 1.011 . . . . 0.0 109.884 177.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . 0.425 HG21 ' CD1' ' A' ' 7' ' ' PHE . 12.7 mm -55.79 -56.15 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.062 0 C-N-CA 123.722 0.809 . . . . 0.0 109.289 169.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 40.7 m -64.36 -26.46 68.48 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.887 0.475 . . . . 0.0 111.279 -170.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.2 ttm180 -58.94 -27.88 65.72 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.836 1.654 . . . . 0.0 113.362 173.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.936 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 -173.957 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.2 tpp . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -60.96 114.52 3.12 Favored 'General case' 0 CA--C 1.517 -0.294 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 168.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -56.92 -43.57 81.55 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.978 -176.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -52.97 -26.37 14.99 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.407 1.483 . . . . 0.0 112.955 -176.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -59.43 -28.55 67.05 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 118.888 0.767 . . . . 0.0 111.971 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -91.21 -12.56 34.94 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 117.545 -1.217 . . . . 0.0 112.859 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -114.02 85.66 10.35 Favored Pre-proline 0 N--CA 1.473 0.703 0 CA-C-N 121.607 2.003 . . . . 0.0 107.832 -173.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -57.92 -53.64 4.15 Favored 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.224 2.616 . . . . 0.0 116.412 -169.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.523 ' C ' ' H ' ' A' ' 11' ' ' SER . 41.6 tt0 -159.64 -88.3 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.041 0.837 . . . . 0.0 113.191 -169.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.9 m -68.77 16.23 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.884 1.674 . . . . 0.0 111.162 177.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.523 ' H ' ' C ' ' A' ' 9' ' ' GLU . 8.7 m -76.92 10.08 2.51 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 128.174 2.589 . . . . 0.0 112.785 -168.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 7.6 mm -139.4 130.11 32.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 N-CA-C 104.071 -2.566 . . . . 0.0 104.071 -171.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.6 m -157.24 136.39 11.86 Favored 'General case' 0 C--N 1.334 -0.106 0 CA-C-N 119.625 1.102 . . . . 0.0 110.621 171.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.6 p -106.03 139.66 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 168.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.8 mt -135.89 143.86 35.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 124.255 1.022 . . . . 0.0 108.315 -168.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 39.6 m80 -67.95 -35.22 78.02 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.925 0.49 . . . . 0.0 111.959 177.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -174.42 144.23 0.89 Allowed 'General case' 0 C--O 1.237 0.429 0 C-N-CA 126.201 1.8 . . . . 0.0 106.431 176.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.411 ' HB3' HG21 ' A' ' 88' ' ' VAL . . . -80.3 150.24 30.04 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 169.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -59.41 -41.29 89.16 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.127 0.571 . . . . 0.0 110.977 -178.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -167.16 -176.24 3.25 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 126.531 1.933 . . . . 0.0 108.052 172.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 24.1 p-90 -68.69 -30.73 69.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.897 0.771 . . . . 0.0 112.817 -176.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.504 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.0 mt-30 -60.83 -47.51 86.01 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 171.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -61.87 -35.71 79.12 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 121.201 -0.937 . . . . 0.0 111.666 176.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.0 -34.07 77.17 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.881 -0.512 . . . . 0.0 110.65 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.72 -46.52 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 171.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -56.46 -46.59 80.3 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 118.227 0.467 . . . . 0.0 110.331 -179.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -62.98 -34.34 77.33 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 117.98 -1.01 . . . . 0.0 111.561 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.2 m -63.85 -21.72 66.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 119.937 1.244 . . . . 0.0 112.484 174.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.0 mmt -123.51 -17.58 6.44 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -169.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.6 p -58.25 -35.4 53.18 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 120.3 1.409 . . . . 0.0 112.399 -169.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 m -60.48 -36.19 77.7 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-N 119.217 0.917 . . . . 0.0 110.819 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 91.6 mt -78.62 -40.44 34.33 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 124.152 0.981 . . . . 0.0 109.199 178.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 43.0 tp -56.99 -40.97 77.55 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.337 0.517 . . . . 0.0 110.24 176.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -68.11 -32.44 72.75 Favored 'General case' 0 C--O 1.231 0.106 0 C-N-CA 124.733 1.213 . . . . 0.0 113.252 -172.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -96.68 17.89 15.49 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.31 0.505 . . . . 0.0 110.672 172.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.43 0.0 OUTLIER 44.18 40.85 3.83 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.579 2.351 . . . . 0.0 115.979 -171.27 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -66.71 -20.4 65.96 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 121.195 -0.941 . . . . 0.0 109.372 167.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.7 pt -143.57 168.87 11.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 C-N-CA 126.928 2.091 . . . . 0.0 108.419 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 64.4 p -101.13 165.88 11.07 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.831 1.252 . . . . 0.0 108.889 169.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -61.4 -30.29 70.46 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.266 -0.897 . . . . 0.0 111.86 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.6 t30 -59.46 -33.68 71.59 Favored 'General case' 0 N--CA 1.464 0.253 0 O-C-N 121.931 -0.481 . . . . 0.0 111.604 177.161 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -59.84 -41.68 91.92 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.344 0.658 . . . . 0.0 111.199 -177.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.6 mp -59.26 -49.51 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -67.36 -29.17 68.64 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 121.61 -0.681 . . . . 0.0 112.757 -178.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.11 -43.48 78.19 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 118.688 0.676 . . . . 0.0 110.907 174.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 51.1 mt -69.36 -44.75 80.02 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.137 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 178.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.504 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.8 mttt -63.22 -41.08 99.08 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.611 -0.681 . . . . 0.0 111.077 -176.197 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -64.16 -39.61 94.36 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.316 1.046 . . . . 0.0 110.623 176.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.0 m -62.59 -36.86 84.05 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.996 -0.44 . . . . 0.0 110.539 172.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 23.9 m -67.83 -38.84 83.72 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.479 0.712 . . . . 0.0 110.39 177.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 79.9 mt -63.69 -41.5 92.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-N 118.901 0.773 . . . . 0.0 110.027 172.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -65.9 -35.2 79.96 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.304 0.642 . . . . 0.0 112.483 -171.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -149.88 -49.26 0.14 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 122.85 0.46 . . . . 0.0 111.759 -168.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 150.31 179.9 26.49 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 109.134 -1.586 . . . . 0.0 109.134 -173.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -61.81 123.4 12.58 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.573 2.182 . . . . 0.0 108.697 179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -78.93 -13.64 59.68 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 112.102 -172.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -134.21 99.36 4.37 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 124.197 0.999 . . . . 0.0 108.383 -169.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 38.6 mm -133.16 140.38 47.23 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 N-CA-C 105.295 -2.113 . . . . 0.0 105.295 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -114.84 -31.62 6.06 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.025 0.53 . . . . 0.0 111.164 175.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -156.45 158.56 31.5 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 125.469 1.508 . . . . 0.0 107.376 -179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.12 124.09 9.76 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.473 2.115 . . . . 0.0 110.104 169.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.66 -0.08 88.01 Favored Glycine 0 CA--C 1.537 1.417 0 CA-C-O 117.791 -1.561 . . . . 0.0 115.077 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 46.3 t -127.78 111.08 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 119.986 1.893 . . . . 0.0 108.033 -176.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -107.74 167.65 9.82 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 123.881 0.872 . . . . 0.0 110.027 174.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 2.4 ttm -141.05 61.58 14.68 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 176.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -52.17 143.04 43.57 Favored 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 121.901 1.734 . . . . 0.0 113.902 -171.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 12.4 t-80 -178.4 154.33 0.8 Allowed 'General case' 0 C--O 1.236 0.357 0 C-N-CA 128.472 2.709 . . . . 0.0 106.388 -170.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -136.65 153.28 50.96 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.961 1.704 . . . . 0.0 107.621 169.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 38.2 mtm105 -53.56 143.16 38.81 Favored Pre-proline 0 CA--C 1.537 0.48 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.33 -178.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_exo -45.5 -43.17 18.05 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.901 3.067 . . . . 0.0 114.145 -171.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.2 -13.53 18.81 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.687 1.195 . . . . 0.0 113.975 -177.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 63.1 m -75.88 -7.15 53.85 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.774 0.83 . . . . 0.0 111.954 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 135.75 14.21 1.03 Allowed Glycine 0 CA--C 1.525 0.705 0 CA-C-O 118.434 -1.203 . . . . 0.0 113.547 177.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.87 144.79 52.41 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 119.904 1.852 . . . . 0.0 109.304 169.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.5 mt -129.68 -32.71 1.89 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 124.854 1.261 . . . . 0.0 110.479 -173.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -143.39 164.76 29.38 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 126.149 1.78 . . . . 0.0 107.968 174.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 85.6 m -97.07 130.94 44.3 Favored 'General case' 0 N--CA 1.446 -0.664 0 C-N-CA 123.218 0.607 . . . . 0.0 110.587 -178.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.46 -179.07 45.77 Favored Glycine 0 CA--C 1.532 1.103 0 C-N-CA 124.954 1.264 . . . . 0.0 110.737 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 47.1 mtt -143.9 171.09 14.71 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 126.46 1.904 . . . . 0.0 110.706 -175.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.85 161.7 41.3 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 126.427 1.891 . . . . 0.0 107.872 177.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.3 tp -141.54 117.56 10.57 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 126.336 1.855 . . . . 0.0 107.274 -172.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 69.6 m -123.37 141.72 51.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.423 HD11 ' HA ' ' A' ' 132' ' ' LEU . 13.9 tp -133.25 146.35 51.34 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 171.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -115.17 135.61 53.99 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.368 1.067 . . . . 0.0 108.573 174.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.05 -40.55 87.14 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 107.114 -1.439 . . . . 0.0 107.114 168.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -123.06 94.01 4.13 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 126.758 2.023 . . . . 0.0 106.825 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -53.93 160.98 4.02 Favored Glycine 0 CA--C 1.526 0.754 0 C-N-CA 124.885 1.231 . . . . 0.0 113.491 -178.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.411 HG21 ' HB3' ' A' ' 18' ' ' ALA . 76.0 t -123.73 149.87 27.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 N-CA-C 106.303 -1.74 . . . . 0.0 106.303 -179.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -112.21 108.64 17.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.079 0.466 . . . . 0.0 111.832 -167.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -63.84 152.46 86.81 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 169.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -74.46 49.68 2.14 Favored 'Trans proline' 0 CA--C 1.549 1.253 0 C-N-CA 123.918 3.079 . . . . 0.0 113.044 176.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 174.67 51.23 0.05 OUTLIER Glycine 0 CA--C 1.529 0.93 0 O-C-N 120.762 -1.211 . . . . 0.0 113.748 177.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.0 t-20 -137.45 172.31 13.17 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.626 1.213 . . . . 0.0 110.198 169.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -73.88 -31.93 63.36 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.143 -0.348 . . . . 0.0 111.607 173.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -151.16 167.07 13.7 Favored Pre-proline 0 CA--C 1.544 0.717 0 C-N-CA 124.306 1.042 . . . . 0.0 111.97 -176.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -53.9 134.06 57.56 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 123.396 2.731 . . . . 0.0 111.809 174.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 26.4 mm -72.79 128.55 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 107.518 -1.289 . . . . 0.0 107.518 175.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -104.74 -15.38 15.25 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-O 117.239 -1.363 . . . . 0.0 111.134 170.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 48.9 tp -141.1 132.11 26.16 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 120.467 1.485 . . . . 0.0 109.645 -171.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.8 mp -137.47 132.43 33.32 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 -177.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.657 ' HB ' HD11 ' A' ' 122' ' ' LEU . 3.0 mt -112.94 117.21 54.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 168.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -75.51 147.41 35.62 Favored Glycine 0 N--CA 1.443 -0.852 0 N-CA-C 108.465 -1.854 . . . . 0.0 108.465 169.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.445 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -141.95 138.65 32.11 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 103.277 -2.86 . . . . 0.0 103.277 169.088 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.445 ' N ' HD23 ' A' ' 103' ' ' LEU . 5.2 m -140.71 143.99 35.34 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.375 -1.713 . . . . 0.0 106.375 169.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -144.23 136.96 26.98 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-N 118.399 0.545 . . . . 0.0 109.734 -169.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -73.92 -22.05 59.82 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.03 0.532 . . . . 0.0 112.097 -178.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -146.31 155.54 42.71 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 123.973 0.909 . . . . 0.0 109.758 -178.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -60.66 -34.43 74.29 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -177.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.59 -31.58 62.08 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 120.807 -1.183 . . . . 0.0 110.946 177.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.7 m -64.49 -39.33 93.6 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.993 -0.442 . . . . 0.0 110.161 170.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 24.9 t60 -58.8 -48.84 79.87 Favored 'General case' 0 C--N 1.343 0.3 0 C-N-CA 123.541 0.737 . . . . 0.0 110.054 171.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 12.2 mm -56.01 -53.02 43.28 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 123.472 0.709 . . . . 0.0 109.168 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.24 -39.35 94.47 Favored Glycine 0 CA--C 1.529 0.966 0 CA-C-N 118.931 0.787 . . . . 0.0 111.929 -177.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.84 -53.48 21.18 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 124.506 1.122 . . . . 0.0 110.64 179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.3 mm -49.89 -47.54 22.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 125.746 1.619 . . . . 0.0 108.883 173.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -67.72 -10.95 57.02 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.427 -0.795 . . . . 0.0 112.384 -177.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -92.35 -48.33 6.72 Favored 'General case' 0 N--CA 1.445 -0.687 0 C-N-CA 124.146 0.979 . . . . 0.0 109.509 170.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.481 HD12 ' N ' ' A' ' 119' ' ' SER . 1.9 pp -70.33 -22.73 62.77 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -176.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.481 ' N ' HD12 ' A' ' 118' ' ' LEU . 44.2 m -63.18 -23.24 67.34 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 123.522 0.729 . . . . 0.0 111.475 173.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -66.84 -17.45 64.89 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.522 -0.736 . . . . 0.0 110.122 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 38.0 mt -108.1 -61.87 1.52 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.822 1.249 . . . . 0.0 110.951 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.657 HD11 ' HB ' ' A' ' 101' ' ' ILE . 72.8 mt -69.63 -8.62 49.14 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 125.21 1.404 . . . . 0.0 114.206 -173.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 36.1 m -120.09 27.68 8.51 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.843 0.857 . . . . 0.0 110.64 175.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -131.44 101.62 5.6 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 125.316 1.446 . . . . 0.0 107.515 176.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -56.8 -27.62 60.13 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.657 0.783 . . . . 0.0 112.217 -177.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -63.13 -48.53 78.12 Favored 'General case' 0 C--O 1.232 0.14 0 C-N-CA 123.465 0.706 . . . . 0.0 109.789 176.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.28 -43.26 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 C-N-CA 123.945 0.898 . . . . 0.0 109.016 177.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.46 HD21 ' HA ' ' A' ' 122' ' ' LEU . 47.5 mt -55.73 -43.2 76.34 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.989 -175.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -66.99 -38.9 86.87 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.479 0.581 . . . . 0.0 110.711 178.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -70.97 -34.7 71.68 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 118.78 0.718 . . . . 0.0 109.863 -175.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 35.1 mt -67.91 -54.35 19.49 Favored 'General case' 0 C--O 1.224 -0.27 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 170.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . 0.423 ' HA ' HD11 ' A' ' 83' ' ' LEU . 29.5 mt -56.57 -23.61 41.59 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -175.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 69.6 p -109.45 5.62 23.51 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.434 1.093 . . . . 0.0 111.876 -178.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.03 106.33 0.82 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 124.271 1.028 . . . . 0.0 110.68 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.5 p -75.55 -1.86 26.38 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.033 1.333 . . . . 0.0 112.999 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 21.4 p -149.78 155.4 40.05 Favored 'General case' 0 C--O 1.233 0.202 0 C-N-CA 124.04 0.936 . . . . 0.0 110.714 -177.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -58.62 -39.28 80.03 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.506 1.122 . . . . 0.0 109.577 173.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -34.26 74.93 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-O 119.006 -0.521 . . . . 0.0 112.06 -178.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -63.17 -44.14 96.3 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 118.603 0.638 . . . . 0.0 110.941 174.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 1.6 mt -63.54 -49.07 74.9 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -58.56 -35.13 71.87 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 173.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -66.74 -43.09 85.11 Favored 'General case' 0 C--N 1.331 -0.197 0 O-C-N 120.962 -1.086 . . . . 0.0 109.86 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 82.9 mt -66.75 -35.16 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 C-N-CA 123.661 0.784 . . . . 0.0 109.199 179.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.1 mm -58.54 -53.14 50.85 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 169.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 25.3 m -63.0 -28.76 70.32 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 122.747 0.419 . . . . 0.0 111.61 -171.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -60.01 -28.28 67.59 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 126.212 1.805 . . . . 0.0 113.565 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.869 0 CA-C-O 117.935 -1.481 . . . . 0.0 109.5 -173.245 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.222 0.058 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.3 mpt_? -66.21 110.21 2.93 Favored 'General case' 0 C--N 1.342 0.245 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 173.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -59.46 -32.63 70.41 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 171.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.58 -18.47 11.98 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.103 0.961 . . . . 0.0 112.443 -178.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -66.09 -22.45 66.4 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 118.883 0.765 . . . . 0.0 112.772 176.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -102.76 -4.85 24.38 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 117.039 -1.458 . . . . 0.0 114.215 -169.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -116.16 88.07 21.43 Favored Pre-proline 0 N--CA 1.475 0.815 0 CA-C-N 122.116 2.234 . . . . 0.0 109.245 -170.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_exo -40.65 -73.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.808 1 C-N-CA 125.723 4.282 . . . . 0.0 116.448 -174.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.448 ' C ' ' H ' ' A' ' 11' ' ' SER . 37.2 tt0 -163.32 -76.72 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.832 0.853 . . . . 0.0 111.252 -171.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.67 6.8 0.58 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.774 1.63 . . . . 0.0 111.914 175.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . 0.448 ' H ' ' C ' ' A' ' 9' ' ' GLU . 3.5 m -73.94 -0.85 17.43 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.571 2.348 . . . . 0.0 113.626 -168.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 15.6 mt -133.48 134.5 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 N-CA-C 105.288 -2.115 . . . . 0.0 105.288 -169.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 73.7 m -156.41 151.71 26.62 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.496 0.718 . . . . 0.0 110.939 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.9 t -118.74 142.22 34.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 105.895 -1.891 . . . . 0.0 105.895 169.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.421 HG22 ' H ' ' A' ' 17' ' ' SER . 15.3 mt -139.41 147.69 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.227 1.811 . . . . 0.0 106.216 -171.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -68.65 -45.54 71.5 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.231 -0.918 . . . . 0.0 110.375 169.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.421 ' H ' HG22 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -170.6 145.95 2.63 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 125.918 1.687 . . . . 0.0 106.455 -177.861 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.29 159.22 27.32 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 174.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt -59.09 -35.7 73.86 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.404 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -164.6 -179.28 5.84 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 127.328 2.251 . . . . 0.0 106.8 170.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 41.8 p-90 -64.97 -33.78 76.86 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.209 -0.932 . . . . 0.0 112.194 171.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.443 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 48.8 mt-30 -55.27 -45.23 76.15 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.75 1.22 . . . . 0.0 108.485 170.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -71.04 -33.56 70.41 Favored 'General case' 0 C--O 1.22 -0.474 0 O-C-N 121.23 -0.919 . . . . 0.0 110.817 177.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.42 -35.08 79.41 Favored 'General case' 0 N--CA 1.451 -0.386 0 O-C-N 121.573 -0.704 . . . . 0.0 110.786 -178.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.94 -47.07 86.62 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 170.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -57.46 -42.24 82.13 Favored 'General case' 0 C--O 1.224 -0.263 0 CA-C-N 118.469 0.577 . . . . 0.0 110.604 179.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -64.68 -33.1 75.16 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.167 0.987 . . . . 0.0 111.614 173.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.9 m -67.16 -17.97 65.07 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.831 1.196 . . . . 0.0 112.03 173.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 6.1 mmt -125.57 -23.48 4.06 Favored 'General case' 0 C--N 1.342 0.266 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -168.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 p -60.25 -36.91 71.53 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 120.837 1.653 . . . . 0.0 111.684 -169.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 15.0 m -67.16 -19.54 65.61 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 118.594 0.634 . . . . 0.0 112.119 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 79.9 mt -86.33 -43.46 12.86 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.908 0.883 . . . . 0.0 109.115 169.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 35.8 tp -56.61 -43.2 79.94 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.92 0.888 . . . . 0.0 110.66 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -67.65 -23.49 65.34 Favored 'General case' 0 C--O 1.232 0.175 0 C-N-CA 125.865 1.666 . . . . 0.0 113.931 -171.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -114.49 26.1 10.5 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.057 0.389 . . . . 0.0 110.592 171.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 60.82 26.38 16.22 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 170.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.405 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 68.0 m-85 -66.97 -23.05 65.9 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.165 -0.959 . . . . 0.0 110.647 169.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.5 pt -142.06 179.61 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 126.702 2.001 . . . . 0.0 107.975 178.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.8 p -123.17 162.65 22.13 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.816 1.646 . . . . 0.0 108.727 170.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.05 -31.68 67.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.06 0.944 . . . . 0.0 113.076 -169.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -60.16 -33.5 72.27 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.746 -0.596 . . . . 0.0 111.794 177.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -59.48 -41.51 89.97 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.722 0.809 . . . . 0.0 110.647 -177.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.12 -52.09 64.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 123.446 0.699 . . . . 0.0 109.552 175.104 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -68.9 -26.84 65.3 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -176.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.71 -41.37 73.71 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.024 0.829 . . . . 0.0 111.03 173.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 33.5 mt -70.29 -45.65 74.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 179.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.443 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 92.5 mttt -66.64 -39.9 88.47 Favored 'General case' 0 C--O 1.224 -0.266 0 O-C-N 121.989 -0.444 . . . . 0.0 111.445 -175.528 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.45 -41.43 98.73 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.24 1.016 . . . . 0.0 110.301 178.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 21.3 m -64.83 -40.85 95.84 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.411 0.684 . . . . 0.0 110.508 173.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 27.8 m -60.07 -40.26 88.9 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.606 -0.684 . . . . 0.0 111.2 174.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 64.1 mt -68.88 -48.02 72.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 119.324 0.966 . . . . 0.0 110.009 176.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -74.64 -32.69 62.36 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -169.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -130.25 -52.45 1.11 Allowed 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 123.732 0.813 . . . . 0.0 110.29 -169.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.81 175.44 15.26 Favored Glycine 0 CA--C 1.527 0.843 0 N-CA-C 110.358 -1.097 . . . . 0.0 110.358 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_endo -54.63 122.09 10.96 Favored 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.807 2.338 . . . . 0.0 108.061 170.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -121.14 9.53 10.51 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -169.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -132.28 92.4 3.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 169.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 27.5 mm -138.24 134.19 44.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 104.77 -2.308 . . . . 0.0 104.77 -174.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -123.71 -28.5 3.84 Favored 'General case' 0 C--O 1.232 0.178 0 C-N-CA 123.468 0.707 . . . . 0.0 111.261 -169.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -160.22 162.91 23.16 Favored Pre-proline 0 CA--C 1.535 0.399 0 C-N-CA 125.717 1.607 . . . . 0.0 107.322 175.266 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -49.1 117.98 3.22 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 122.694 2.263 . . . . 0.0 110.893 169.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.85 1.01 77.42 Favored Glycine 0 CA--C 1.53 0.97 0 CA-C-O 117.931 -1.483 . . . . 0.0 114.064 178.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.3 t -128.9 118.91 48.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 119.803 1.801 . . . . 0.0 108.698 -169.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -121.31 166.89 13.39 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.554 1.542 . . . . 0.0 110.104 179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 25.0 ttm -135.8 60.63 37.1 Favored Pre-proline 0 CA--C 1.539 0.551 0 C-N-CA 123.166 0.586 . . . . 0.0 110.163 172.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_exo -59.3 121.22 9.54 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 121.946 1.764 . . . . 0.0 110.15 -171.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -172.5 162.49 5.28 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 127.634 2.374 . . . . 0.0 107.173 -169.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -135.87 172.42 13.04 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.709 1.204 . . . . 0.0 109.867 -174.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -58.5 154.01 36.28 Favored Pre-proline 0 CA--C 1.537 0.467 0 CA-C-O 118.468 -0.777 . . . . 0.0 109.605 173.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -57.55 -40.03 83.74 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.462 2.108 . . . . 0.0 109.972 -177.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -64.61 -12.59 47.17 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.402 1.481 . . . . 0.0 112.94 -176.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 80.9 m -77.34 -5.37 49.35 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.777 0.717 . . . . 0.0 111.965 178.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 130.69 18.44 1.41 Allowed Glycine 0 CA--C 1.524 0.607 0 CA-C-O 118.405 -1.219 . . . . 0.0 113.112 175.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.09 146.07 53.81 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 119.281 1.541 . . . . 0.0 109.026 169.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.8 mt -132.77 -29.47 1.5 Allowed 'General case' 0 C--N 1.333 -0.132 0 C-N-CA 123.973 0.909 . . . . 0.0 111.183 -173.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.405 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 64.5 mttt -147.17 156.15 42.73 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 125.031 1.332 . . . . 0.0 107.827 177.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' ' 105' ' ' ALA . 93.7 m -88.28 128.57 35.48 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 123.04 0.536 . . . . 0.0 111.057 -176.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -176.92 -178.8 46.95 Favored Glycine 0 CA--C 1.533 1.216 0 C-N-CA 125.347 1.451 . . . . 0.0 110.854 -176.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.659 ' SD ' HD21 ' A' ' 118' ' ' LEU . 53.5 mtt -148.57 172.46 14.49 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 127.018 2.127 . . . . 0.0 110.077 -175.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 60.7 m -152.75 168.21 26.45 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.209 1.403 . . . . 0.0 109.157 169.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.421 HD22 HD11 ' A' ' 144' ' ' ILE . 12.9 tp -145.59 125.51 13.56 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 126.448 1.899 . . . . 0.0 108.737 -169.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 73.2 m -133.56 145.33 49.99 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 124.974 1.31 . . . . 0.0 108.296 -176.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.472 HD23 ' N ' ' A' ' 84' ' ' LEU . 5.6 tt -136.29 132.77 36.16 Favored 'General case' 0 C--N 1.339 0.122 0 N-CA-C 106.838 -1.541 . . . . 0.0 106.838 174.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.472 ' N ' HD23 ' A' ' 83' ' ' LEU . 9.2 mp -114.09 121.31 43.44 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 126.865 2.066 . . . . 0.0 106.376 178.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -60.77 -36.91 80.17 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.247 0.93 . . . . 0.0 112.745 -177.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -92.96 -14.93 26.86 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.286 0.634 . . . . 0.0 112.156 176.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 66.97 -176.44 21.67 Favored Glycine 0 CA--C 1.534 1.271 0 N-CA-C 110.075 -1.21 . . . . 0.0 110.075 -168.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 1.2 p -150.66 164.43 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.372 0 O-C-N 121.663 -0.904 . . . . 0.0 108.659 169.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -102.37 110.71 22.74 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.458 0.647 . . . . 0.0 109.837 -169.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -82.65 118.89 73.34 Favored Pre-proline 0 CA--C 1.539 0.534 0 C-N-CA 125.594 1.558 . . . . 0.0 108.118 170.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -61.63 112.96 1.61 Allowed 'Trans proline' 0 N--CA 1.459 -0.517 0 C-N-CA 123.181 2.587 . . . . 0.0 110.847 -170.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 126.81 -17.85 6.34 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 124.588 1.089 . . . . 0.0 112.887 -178.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -132.57 97.72 4.15 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 174.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.33 -27.49 67.39 Favored 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -169.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 24.5 tp10 -68.29 128.44 93.15 Favored Pre-proline 0 N--CA 1.438 -1.042 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.53 129.86 18.6 Favored 'Trans proline' 0 N--CA 1.452 -0.966 0 C-N-CA 122.295 1.997 . . . . 0.0 109.22 -176.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 31.4 mm -72.38 107.74 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.246 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 178.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 32.0 mtpt -84.59 -18.86 34.2 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-O 117.094 -1.431 . . . . 0.0 111.513 171.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 8.4 mt -137.97 139.24 39.6 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 120.703 1.592 . . . . 0.0 111.837 -174.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.9 mp -140.7 134.63 30.63 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 -175.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.64 HG21 HD22 ' A' ' 118' ' ' LEU . 5.0 mt -119.94 126.49 75.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 N-CA-C 107.121 -1.437 . . . . 0.0 107.121 169.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -85.18 153.58 28.01 Favored Glycine 0 CA--C 1.522 0.517 0 N-CA-C 108.834 -1.706 . . . . 0.0 108.834 169.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.516 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -149.99 144.26 25.72 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 105.344 -2.095 . . . . 0.0 105.344 173.877 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.516 ' N ' HD23 ' A' ' 103' ' ' LEU . 79.5 p -142.29 146.38 35.01 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 105.565 -2.013 . . . . 0.0 105.565 168.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.665 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -144.15 148.17 34.67 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 171.018 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -83.78 -13.85 52.88 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.012 -174.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -135.5 152.53 51.42 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.619 0.768 . . . . 0.0 110.171 174.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -61.27 -35.23 76.73 Favored 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -177.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -72.22 -31.17 65.61 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 121.09 -1.006 . . . . 0.0 110.808 176.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.505 ' HB2' ' HB1' ' A' ' 105' ' ' ALA . 16.3 m -63.84 -38.82 92.52 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 118.719 -0.658 . . . . 0.0 109.658 169.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.665 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 24.8 m-70 -61.93 -43.33 99.07 Favored 'General case' 0 C--N 1.344 0.345 0 CA-C-N 119.401 1.0 . . . . 0.0 110.767 172.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 19.8 mm -57.82 -55.57 20.84 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.312 0 CA-C-N 119.428 1.013 . . . . 0.0 109.331 177.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -58.92 -39.32 93.92 Favored Glycine 0 CA--C 1.528 0.849 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 -177.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.435 ' CB ' HD21 ' A' ' 103' ' ' LEU . . . -67.51 -49.05 65.21 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.308 1.043 . . . . 0.0 111.267 179.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.4 mm -56.36 -42.95 75.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.231 1.013 . . . . 0.0 108.643 176.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -70.98 -12.35 61.49 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.75 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -82.98 -45.51 14.01 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 169.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.659 HD21 ' SD ' ' A' ' 79' ' ' MET . 92.5 mt -71.54 -26.94 62.85 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-O 118.887 -0.578 . . . . 0.0 112.062 -174.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 20.1 m -60.83 -24.43 65.86 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.096 0.407 . . . . 0.0 111.591 170.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.53 -16.41 62.33 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 120.748 -1.22 . . . . 0.0 110.688 175.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 42.2 mt -104.52 -67.56 0.9 Allowed 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.322 1.049 . . . . 0.0 109.713 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 16.9 mt -75.48 -6.35 49.71 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 -171.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 33.4 m -119.86 29.7 7.42 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.175 0.898 . . . . 0.0 110.457 174.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -131.33 108.5 9.69 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 172.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -57.68 -27.38 62.83 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.632 -177.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -63.78 -45.25 90.6 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 123.25 0.62 . . . . 0.0 110.003 176.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.6 mp -70.54 -41.23 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 118.409 -0.805 . . . . 0.0 109.135 175.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 35.3 mt -56.14 -39.78 72.78 Favored 'General case' 0 C--O 1.226 -0.184 0 CA-C-N 119.34 0.973 . . . . 0.0 111.231 -175.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -69.87 -37.33 76.05 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.01 176.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -65.35 -41.44 93.85 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 119.336 0.971 . . . . 0.0 109.106 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 22.9 mt -66.19 -52.85 44.12 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 175.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 51.1 mt -59.37 -17.4 29.66 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -176.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 77.6 p -108.24 3.2 23.36 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.629 1.172 . . . . 0.0 112.09 177.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.45 140.19 58.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.403 1.081 . . . . 0.0 109.257 169.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.5 m -132.46 1.84 3.78 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.028 1.331 . . . . 0.0 111.234 178.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 17.2 m -144.28 150.62 38.19 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 124.115 0.966 . . . . 0.0 109.442 -177.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.2 -43.16 92.25 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.957 1.303 . . . . 0.0 110.649 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -60.02 -35.29 74.76 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 123.054 0.542 . . . . 0.0 111.287 177.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -64.56 -40.34 95.39 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 123.948 0.899 . . . . 0.0 111.161 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 30.1 mt -65.61 -46.15 80.4 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.22 -27.31 69.27 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 174.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -65.57 -38.18 88.81 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 120.52 -1.363 . . . . 0.0 109.913 174.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 66.2 mt -69.55 -35.47 66.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 C-N-CA 124.141 0.976 . . . . 0.0 109.562 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . 0.421 HD11 HD22 ' A' ' 81' ' ' LEU . 27.9 mm -56.26 -50.75 69.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 169.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 18.7 m -65.12 -30.61 71.55 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 123.281 0.363 . . . . 0.0 110.966 -173.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -60.11 -27.61 67.17 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.218 1.407 . . . . 0.0 113.296 172.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 N-CA-C 108.79 -1.724 . . . . 0.0 108.79 -179.028 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.485 1.317 0 CA-C-O 120.467 0.175 . . . . 0.0 111.003 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.21 109.01 3.38 Favored 'General case' 0 CA--C 1.514 -0.437 0 N-CA-C 108.731 -0.841 . . . . 0.0 108.731 172.145 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -58.36 -31.69 67.85 Favored 'General case' 0 C--O 1.225 -0.208 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 169.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -51.6 -21.1 2.33 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.931 1.692 . . . . 0.0 113.319 177.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -64.02 -25.19 68.01 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 119.304 0.957 . . . . 0.0 113.468 174.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -101.19 -21.66 14.87 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -169.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -103.97 103.99 40.76 Favored Pre-proline 0 CA--C 1.539 0.544 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 -170.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -59.19 -68.04 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.511 2.807 . . . . 0.0 113.968 -171.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -163.28 -74.73 0.04 OUTLIER 'General case' 0 CA--C 1.521 -0.164 0 C-N-CA 124.155 0.982 . . . . 0.0 111.028 -173.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.13 3.11 1.25 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.104 1.362 . . . . 0.0 111.917 177.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -15.28 63.5 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.815 1.646 . . . . 0.0 113.24 -169.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.4 mp -117.83 137.27 52.3 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 -171.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.1 m -156.97 139.86 15.26 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 118.572 0.624 . . . . 0.0 110.917 176.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 92.7 t -105.0 137.11 35.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 104.764 -2.31 . . . . 0.0 104.764 169.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 40.9 mt -137.74 148.81 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 -176.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 42.8 m80 -66.05 -45.82 79.99 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.584 -0.697 . . . . 0.0 110.733 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.1 p -164.9 144.39 6.98 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.815 1.246 . . . . 0.0 108.144 -176.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -79.23 156.75 28.0 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 169.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.0 ttpt -60.05 -40.92 91.07 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.576 176.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -167.41 -177.49 3.63 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 128.201 2.6 . . . . 0.0 107.505 171.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 68.9 p-90 -62.17 -34.15 75.88 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.479 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 34.5 mt-30 -60.66 -48.43 81.81 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 120.578 1.535 . . . . 0.0 107.906 173.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -62.64 -35.86 80.96 Favored 'General case' 0 C--O 1.224 -0.28 0 O-C-N 121.307 -0.871 . . . . 0.0 111.451 176.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.18 -35.93 82.4 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 121.766 -0.584 . . . . 0.0 110.544 -178.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -65.64 -47.89 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.442 -0.947 . . . . 0.0 108.442 172.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -58.44 -48.02 82.08 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 118.434 0.561 . . . . 0.0 110.762 -177.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -59.7 -30.01 68.49 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.287 1.035 . . . . 0.0 111.356 174.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 31.5 m -84.58 -9.91 57.87 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 119.383 0.992 . . . . 0.0 113.565 178.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.2 mmt -124.72 -21.52 4.78 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 119.99 1.268 . . . . 0.0 112.757 -172.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.22 -37.28 55.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 120.489 1.495 . . . . 0.0 111.125 -175.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 12.1 m -64.48 -25.71 68.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 O-C-N 121.598 -0.689 . . . . 0.0 112.425 -179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 81.6 mt -87.51 -40.98 13.83 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 124.127 0.971 . . . . 0.0 109.061 175.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.2 tp -56.15 -41.72 75.84 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.563 1.145 . . . . 0.0 110.4 176.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -65.67 -32.64 74.31 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 125.426 1.49 . . . . 0.0 112.673 -174.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 25.3 mmtt -94.69 15.84 17.21 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.217 0.462 . . . . 0.0 110.818 173.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.33 3.5 p30 46.89 42.57 12.36 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.889 1.675 . . . . 0.0 114.079 -172.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -69.88 -21.84 63.29 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.501 -0.749 . . . . 0.0 109.324 168.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.6 pt -147.12 170.43 3.92 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 127.096 2.158 . . . . 0.0 108.159 -174.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 71.8 p -105.85 168.13 9.32 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.039 1.336 . . . . 0.0 109.187 169.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.89 -30.06 71.18 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.254 -0.904 . . . . 0.0 111.997 -175.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -60.59 -32.55 71.65 Favored 'General case' 0 N--CA 1.466 0.349 0 O-C-N 121.788 -0.57 . . . . 0.0 111.474 175.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -59.88 -43.42 94.74 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.539 0.609 . . . . 0.0 110.563 -177.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 3.1 mp -55.33 -50.11 67.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 C-N-CA 123.315 0.646 . . . . 0.0 109.365 174.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -71.43 -25.38 62.3 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.665 -0.683 . . . . 0.0 111.923 -175.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.58 -43.82 97.85 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 119.434 1.015 . . . . 0.0 110.801 173.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 48.4 mt -63.99 -45.41 96.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 177.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.8 mttt -61.62 -37.98 85.96 Favored 'General case' 0 C--O 1.223 -0.296 0 O-C-N 122.042 -0.411 . . . . 0.0 110.229 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -64.45 -43.49 94.1 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 119.083 0.856 . . . . 0.0 111.33 177.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 49.4 m -59.12 -38.75 80.34 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.753 0.706 . . . . 0.0 110.611 171.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 31.5 m -64.51 -40.4 95.57 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.564 0.746 . . . . 0.0 111.064 178.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 94.3 mt -62.94 -44.22 99.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 119.444 1.02 . . . . 0.0 109.122 173.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 -72.61 -36.24 68.05 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -170.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 30.8 t-20 -141.14 9.19 2.09 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -167.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 69.19 -169.86 42.57 Favored Glycine 0 CA--C 1.534 1.277 0 N-CA-C 110.038 -1.225 . . . . 0.0 110.038 -169.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -64.13 108.49 0.97 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.195 1.93 . . . . 0.0 108.085 177.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 2.4 p90 -89.56 1.08 56.42 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.634 0.605 . . . . 0.0 112.634 -169.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -130.91 108.79 10.08 Favored 'General case' 0 C--O 1.231 0.108 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 169.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.5 mm -141.01 134.54 31.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 103.114 -2.921 . . . . 0.0 103.114 -178.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mp -130.62 -21.2 2.82 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -169.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.29 160.43 30.45 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 172.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -57.67 121.36 9.89 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 121.927 1.751 . . . . 0.0 109.565 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.54 2.53 76.08 Favored Glycine 0 CA--C 1.53 1.012 0 CA-C-O 117.895 -1.503 . . . . 0.0 114.445 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.7 t -133.39 118.67 32.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-N 120.312 2.056 . . . . 0.0 109.275 -169.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -116.19 163.35 16.1 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 125.362 1.465 . . . . 0.0 109.818 179.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 7.5 ttm -137.79 61.08 27.54 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-O 118.59 -0.719 . . . . 0.0 109.862 171.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . 0.28 93.7 Cg_exo -31.22 -85.64 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.016 1 C-N-CA 125.786 4.324 . . . . 0.0 118.763 -168.305 . . . . . . . . 3 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 54.72 164.13 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 126.905 2.082 . . . . 0.0 114.61 -176.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -141.97 155.87 45.46 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 126.478 1.911 . . . . 0.0 106.916 170.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -50.86 147.75 8.31 Favored Pre-proline 0 CA--C 1.536 0.42 0 CA-C-O 118.08 -0.962 . . . . 0.0 110.034 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_exo -46.68 -41.97 24.18 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.217 2.611 . . . . 0.0 112.876 176.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -61.6 -14.28 29.1 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.799 1.24 . . . . 0.0 113.842 -177.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 79.2 m -79.84 -3.08 46.31 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.712 0.805 . . . . 0.0 112.247 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 128.66 18.92 1.72 Allowed Glycine 0 C--N 1.336 0.562 0 CA-C-O 118.748 -1.029 . . . . 0.0 112.959 175.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.4 148.67 49.29 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 119.468 1.634 . . . . 0.0 109.269 170.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 76.5 mt -131.9 -32.25 1.45 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 124.828 1.251 . . . . 0.0 110.77 -175.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 76.4 mttt -143.31 163.15 33.79 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 125.942 1.697 . . . . 0.0 107.816 178.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 98.3 m -97.71 122.62 41.01 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 123.189 0.596 . . . . 0.0 109.91 -177.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -168.88 179.83 41.44 Favored Glycine 0 CA--C 1.534 1.239 0 C-N-CA 125.25 1.405 . . . . 0.0 111.348 -176.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.7 ' SD ' HD21 ' A' ' 118' ' ' LEU . 52.1 mtt -149.02 168.34 23.39 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 125.44 1.496 . . . . 0.0 111.23 -170.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 3.2 p -148.54 164.91 32.8 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.454 1.502 . . . . 0.0 109.852 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.523 HD22 HD11 ' A' ' 144' ' ' ILE . 21.1 tp -146.28 90.03 1.92 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 125.602 1.561 . . . . 0.0 109.923 -169.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 11.1 m -97.45 143.75 27.86 Favored 'General case' 0 C--O 1.233 0.2 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.0 tp -133.25 136.78 45.76 Favored 'General case' 0 N--CA 1.453 -0.287 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 169.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -115.69 116.34 27.91 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 104.705 -2.331 . . . . 0.0 104.705 174.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -65.42 -33.44 75.96 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 118.701 0.682 . . . . 0.0 112.328 -176.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 77.6 mm-40 -85.48 -13.43 49.14 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.919 0.888 . . . . 0.0 111.722 173.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 68.75 177.23 13.7 Favored Glycine 0 CA--C 1.533 1.181 0 N-CA-C 110.265 -1.134 . . . . 0.0 110.265 -168.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -146.12 161.15 10.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 168.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -108.95 103.0 11.96 Favored 'General case' 0 C--N 1.331 -0.217 0 O-C-N 121.409 -0.807 . . . . 0.0 110.024 -169.263 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -67.0 142.06 97.07 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 114.924 -1.035 . . . . 0.0 109.097 170.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -63.79 137.67 59.65 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.929 2.419 . . . . 0.0 111.754 -169.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 71.49 0.18 37.45 Favored Glycine 0 CA--C 1.531 1.065 0 CA-C-O 118.527 -1.152 . . . . 0.0 114.962 170.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -75.96 166.23 23.8 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 119.681 1.741 . . . . 0.0 110.633 178.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -64.51 -38.87 92.53 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.938 -0.476 . . . . 0.0 111.77 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -152.7 169.28 9.88 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 124.524 1.13 . . . . 0.0 112.43 -177.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -56.16 159.74 11.98 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 124.195 3.263 . . . . 0.0 114.041 174.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 27.0 mm -108.1 123.5 63.68 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.276 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 178.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 27.5 mtpt -89.05 -32.52 17.53 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-O 116.819 -1.562 . . . . 0.0 109.878 169.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.46 HD22 HD22 ' A' ' 131' ' ' LEU . 1.9 tp -130.49 144.09 51.18 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 121.1 1.773 . . . . 0.0 112.297 -172.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.3 mp -132.95 109.16 9.38 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.008 1.323 . . . . 0.0 107.707 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.724 HG21 HD22 ' A' ' 118' ' ' LEU . 0.5 OUTLIER -87.74 115.27 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 104.72 -2.326 . . . . 0.0 104.72 168.729 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -83.73 153.33 29.77 Favored Glycine 0 CA--C 1.527 0.784 0 N-CA-C 109.321 -1.511 . . . . 0.0 109.321 170.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.434 HD23 ' N ' ' A' ' 104' ' ' SER . 0.4 OUTLIER -145.35 144.35 30.65 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 103.872 -2.64 . . . . 0.0 103.872 171.372 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.434 ' N ' HD23 ' A' ' 103' ' ' LEU . 11.3 m -142.32 142.47 32.51 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 105.587 -2.005 . . . . 0.0 105.587 169.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -145.1 136.3 24.96 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 -170.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.85 -24.46 52.67 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.907 0.483 . . . . 0.0 111.889 -175.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -143.53 157.41 44.46 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.896 0.878 . . . . 0.0 110.081 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.31 -35.12 73.22 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.52 -32.4 60.48 Favored 'General case' 0 N--CA 1.465 0.285 0 O-C-N 120.904 -1.122 . . . . 0.0 111.033 177.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.8 m -62.02 -42.28 99.0 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 169.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 22.2 t60 -57.71 -49.04 77.87 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.134 0.974 . . . . 0.0 110.17 173.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 10.4 mm -56.41 -54.98 21.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-N 118.89 0.768 . . . . 0.0 109.604 179.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -59.71 -38.85 94.46 Favored Glycine 0 CA--C 1.53 0.986 0 CA-C-N 118.549 0.613 . . . . 0.0 111.582 -176.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -68.37 -49.86 57.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.674 1.189 . . . . 0.0 110.901 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.0 mm -55.83 -42.7 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 124.588 1.155 . . . . 0.0 109.145 176.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 91.7 mm-40 -69.54 -14.59 62.93 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-O 118.381 -0.818 . . . . 0.0 111.936 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -83.85 -42.34 16.51 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 170.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.724 HD22 HG21 ' A' ' 101' ' ' ILE . 96.4 mt -68.76 -29.3 67.66 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 121.78 -0.575 . . . . 0.0 111.708 -177.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 25.1 m -56.61 -22.49 34.33 Favored 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 170.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 13.1 mm-40 -77.24 -18.29 57.76 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 119.584 1.084 . . . . 0.0 111.519 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 42.9 mt -103.51 -61.26 1.44 Allowed 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.971 0.908 . . . . 0.0 110.103 -177.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.51 -27.65 69.29 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 123.92 0.888 . . . . 0.0 113.046 -174.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 34.5 m -106.93 29.32 7.16 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 123.134 0.574 . . . . 0.0 110.577 -175.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -130.59 104.88 7.47 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 123.909 0.884 . . . . 0.0 108.686 175.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -58.63 -25.55 62.8 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.08 -177.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -65.53 -48.22 73.22 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 121.273 0.559 . . . . 0.0 109.564 175.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.59 -42.2 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 123.885 0.874 . . . . 0.0 109.013 175.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 45.5 mt -60.86 -33.91 73.8 Favored 'General case' 0 C--O 1.226 -0.174 0 CA-C-N 118.714 0.688 . . . . 0.0 111.758 178.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -69.34 -43.46 73.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 120.821 -1.175 . . . . 0.0 109.587 172.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -62.95 -33.29 75.04 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 118.864 0.756 . . . . 0.0 110.321 -177.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.46 HD22 HD22 ' A' ' 99' ' ' LEU . 3.8 pp -81.16 -42.0 21.53 Favored 'General case' 0 C--N 1.342 0.241 0 C-N-CA 123.451 0.7 . . . . 0.0 111.2 177.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 55.2 mt -64.48 -20.25 66.07 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.551 1.069 . . . . 0.0 111.743 176.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 59.9 p -108.79 16.33 22.86 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.983 1.313 . . . . 0.0 111.167 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.39 102.62 0.71 Allowed 'General case' 0 C--N 1.346 0.42 0 CA-C-N 119.254 0.934 . . . . 0.0 111.18 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 22.3 m -71.75 -17.0 62.22 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.496 0.718 . . . . 0.0 112.272 175.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 75.3 p -153.76 162.44 41.24 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.813 0.733 . . . . 0.0 111.184 -171.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -57.61 -37.24 72.92 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.418 1.087 . . . . 0.0 109.401 169.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 58.1 tptt -58.39 -44.16 88.81 Favored 'General case' 0 C--N 1.342 0.273 0 CA-C-O 118.618 -0.706 . . . . 0.0 110.916 176.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -60.04 -38.13 81.86 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 119.122 0.874 . . . . 0.0 112.121 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 38.3 mt -69.9 -44.77 69.02 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.706 0.685 . . . . 0.0 109.971 177.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -65.55 -26.58 67.94 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.087 -1.008 . . . . 0.0 112.569 175.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -66.15 -35.81 81.47 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 120.344 -1.472 . . . . 0.0 110.826 174.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 81.4 mt -63.44 -39.34 84.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.729 0.811 . . . . 0.0 109.784 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . 0.523 HD11 HD22 ' A' ' 81' ' ' LEU . 33.7 mm -58.21 -51.51 70.19 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 173.026 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 19.9 m -65.57 -24.53 67.11 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.469 -169.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.472 ' HG3' HH11 ' A' ' 146' ' ' ARG . 2.2 ttm-85 -60.19 -25.29 65.46 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.398 1.479 . . . . 0.0 113.825 173.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.973 -0.904 . . . . 0.0 111.065 -173.666 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.3 tpt . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.43 112.84 1.91 Allowed 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 169.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.56 -34.01 73.53 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 169.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 2.9 p -59.53 -5.74 0.91 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.921 1.688 . . . . 0.0 113.413 171.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -109.19 11.54 25.44 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.098 1.359 . . . . 0.0 113.341 174.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -130.96 -46.63 1.02 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.34 1.056 . . . . 0.0 109.6 169.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -75.22 118.26 69.27 Favored Pre-proline 0 CA--C 1.542 0.642 0 N-CA-C 104.302 -2.481 . . . . 0.0 104.302 170.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.9 -78.71 0.01 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.646 2.231 . . . . 0.0 111.394 -169.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -168.5 165.39 12.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 128.316 2.646 . . . . 0.0 104.88 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 56.99 15.74 2.49 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.711 1.204 . . . . 0.0 113.719 171.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.5 m -117.53 28.64 8.33 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 124.95 1.3 . . . . 0.0 110.489 -169.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.2 mt -122.73 144.54 31.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 107.427 -1.323 . . . . 0.0 107.427 171.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 69.9 m -157.07 157.33 34.39 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.852 0.861 . . . . 0.0 109.488 169.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 99.2 t -122.21 141.06 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 104.248 -2.501 . . . . 0.0 104.248 170.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.5 mt -136.18 144.11 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 125.29 1.436 . . . . 0.0 107.86 -168.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -70.68 -36.04 73.11 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.159 -0.338 . . . . 0.0 111.24 177.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.3 p -175.11 146.41 0.85 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 126.299 1.84 . . . . 0.0 106.292 -179.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -85.28 157.67 20.52 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 169.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -62.7 -37.11 85.18 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.009 179.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -165.2 -179.46 5.64 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 126.754 2.021 . . . . 0.0 107.125 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 69.0 p-90 -61.78 -35.17 77.37 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 118.882 0.765 . . . . 0.0 111.864 171.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.489 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 51.3 mt-30 -51.79 -53.94 34.32 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.64 1.176 . . . . 0.0 108.191 170.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -66.57 -34.39 77.78 Favored 'General case' 0 C--O 1.221 -0.437 0 O-C-N 121.684 -0.635 . . . . 0.0 111.185 -179.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -66.24 -31.56 72.46 Favored 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 121.82 -0.55 . . . . 0.0 110.795 179.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.74 -48.3 80.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.176 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 170.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -56.51 -46.21 80.66 Favored 'General case' 0 C--O 1.223 -0.327 0 O-C-N 122.033 -0.417 . . . . 0.0 110.08 178.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -64.52 -29.32 70.35 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 118.003 -0.998 . . . . 0.0 112.293 175.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 41.2 m -66.93 -23.53 65.98 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 120.17 1.35 . . . . 0.0 111.869 172.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.1 mmt -123.79 -17.96 6.19 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 -168.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.8 p -57.17 -34.82 46.41 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 120.276 1.398 . . . . 0.0 112.472 -169.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.5 m -64.77 -44.65 89.34 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 118.654 0.661 . . . . 0.0 109.727 178.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 89.3 mt -65.05 -36.67 85.1 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.182 0.593 . . . . 0.0 109.709 177.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 51.1 tp -61.61 -48.25 81.76 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.22 0.608 . . . . 0.0 109.924 177.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -65.42 -37.14 86.04 Favored 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 124.157 0.983 . . . . 0.0 112.168 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt -76.56 2.11 14.84 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.604 1.162 . . . . 0.0 111.859 175.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.414 0.0 OUTLIER 48.64 30.34 2.5 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.703 2.401 . . . . 0.0 116.019 -169.956 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -66.68 -23.66 66.16 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.11 -0.994 . . . . 0.0 109.762 168.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.0 pt -140.88 179.28 2.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.558 0 C-N-CA 126.063 1.745 . . . . 0.0 109.905 -177.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.6 m -121.09 160.53 23.47 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.899 2.08 . . . . 0.0 108.46 175.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -60.02 -33.23 71.72 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 121.318 -0.864 . . . . 0.0 112.883 -171.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -59.51 -30.82 68.84 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 121.864 -0.522 . . . . 0.0 111.885 176.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -61.16 -42.7 99.02 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.312 0.645 . . . . 0.0 110.574 -177.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 4.1 mp -59.4 -50.38 80.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 174.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -68.78 -25.89 64.93 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.501 -0.762 . . . . 0.0 112.003 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.73 -43.76 98.22 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 119.473 1.033 . . . . 0.0 110.909 174.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 55.9 mt -66.96 -44.06 88.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.489 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 91.6 mttt -60.9 -44.64 96.86 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.352 0.523 . . . . 0.0 109.915 -178.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -63.69 -37.28 86.75 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.125 0.97 . . . . 0.0 111.47 178.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.0 m -63.31 -38.02 89.54 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.635 -0.666 . . . . 0.0 110.44 172.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 17.5 m -66.73 -35.38 79.98 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.434 0.694 . . . . 0.0 110.738 176.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 95.4 mt -65.11 -44.09 95.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 119.221 0.919 . . . . 0.0 109.638 171.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -64.91 -34.91 79.52 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.61 0.764 . . . . 0.0 112.561 -169.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -149.96 -48.43 0.13 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.087 0.555 . . . . 0.0 111.309 -169.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 146.56 -178.64 24.09 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 109.084 -1.607 . . . . 0.0 109.084 -173.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_endo -60.19 122.66 11.7 Favored 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 122.332 2.021 . . . . 0.0 109.619 -179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -80.02 -17.66 52.24 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.614 0.598 . . . . 0.0 112.614 -172.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -129.57 95.69 4.06 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 -171.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 21.1 mm -135.2 142.42 39.94 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 126.6 1.96 . . . . 0.0 105.914 -174.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 3.1 mp -132.16 -28.6 1.7 Allowed 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 123.38 0.672 . . . . 0.0 112.124 -173.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -157.13 164.87 20.2 Favored Pre-proline 0 C--O 1.238 0.47 0 C-N-CA 125.11 1.364 . . . . 0.0 107.596 173.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_exo -50.13 123.45 11.0 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.28 1.987 . . . . 0.0 109.507 169.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.54 3.66 90.43 Favored Glycine 0 CA--C 1.535 1.338 0 CA-C-O 117.892 -1.504 . . . . 0.0 115.204 178.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 58.0 t -128.27 122.76 58.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 120.241 2.021 . . . . 0.0 108.56 -173.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -125.78 163.05 23.71 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 124.948 1.299 . . . . 0.0 110.262 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 23.2 ttm -132.8 60.46 50.11 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 123.414 0.686 . . . . 0.0 111.64 175.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -50.59 143.62 27.79 Favored 'Trans proline' 0 CA--C 1.541 0.867 0 C-N-CA 122.304 2.003 . . . . 0.0 114.432 -171.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 -179.72 154.9 0.62 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 128.205 2.602 . . . . 0.0 106.672 -169.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -138.07 161.66 36.17 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 125.515 1.526 . . . . 0.0 107.631 169.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.6 ptt85 -49.93 139.56 17.08 Favored Pre-proline 0 CA--C 1.54 0.568 0 CA-C-O 118.079 -0.962 . . . . 0.0 109.729 175.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_exo -46.89 -43.26 24.38 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 123.692 2.928 . . . . 0.0 113.008 -176.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -63.08 -9.65 11.33 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.484 1.514 . . . . 0.0 114.368 -177.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 64.0 m -76.47 -3.91 39.75 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.011 0.823 . . . . 0.0 112.388 172.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 132.66 13.29 1.65 Allowed Glycine 0 C--N 1.334 0.456 0 CA-C-O 118.305 -1.275 . . . . 0.0 113.373 171.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.4 145.17 56.16 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 119.296 1.548 . . . . 0.0 109.231 169.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 88.0 mt -126.2 -33.92 2.58 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 124.444 1.098 . . . . 0.0 110.261 -175.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -139.52 168.59 19.48 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 126.103 1.761 . . . . 0.0 107.873 176.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 96.9 m -98.8 118.53 35.75 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 123.351 0.66 . . . . 0.0 109.247 177.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -165.63 177.82 40.7 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 123.804 0.716 . . . . 0.0 112.382 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.721 ' SD ' HD21 ' A' ' 118' ' ' LEU . 59.0 mtt -142.22 166.97 23.24 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.737 1.269 . . . . 0.0 112.841 -171.426 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.2 p -145.58 158.55 43.83 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.264 1.826 . . . . 0.0 108.762 178.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 2.9 mp -134.44 133.16 40.18 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.988 1.315 . . . . 0.0 107.542 -178.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 26.6 m -139.05 134.9 33.6 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -174.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 10.1 tp -123.56 142.18 51.28 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 169.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 7.9 mp -121.34 115.98 23.95 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 126.973 2.109 . . . . 0.0 105.584 177.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -62.99 -25.03 68.19 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.115 0.966 . . . . 0.0 112.486 -174.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -110.52 -7.98 14.68 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.8 1.24 . . . . 0.0 111.765 177.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 59.39 -176.37 2.94 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 123.842 0.734 . . . . 0.0 112.065 -169.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -151.49 157.92 5.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 106.268 -1.753 . . . . 0.0 106.268 169.146 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -98.26 109.77 22.47 Favored 'General case' 0 C--N 1.333 -0.133 0 O-C-N 121.182 -0.949 . . . . 0.0 112.139 -169.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -82.85 114.74 54.43 Favored Pre-proline 0 N--CA 1.449 -0.523 0 N-CA-C 106.241 -1.762 . . . . 0.0 106.241 169.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -61.34 108.13 0.56 Allowed 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.557 2.171 . . . . 0.0 110.936 -169.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 140.78 -31.19 2.23 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-O 118.808 -0.996 . . . . 0.0 113.153 177.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -69.9 162.0 28.85 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.169 1.485 . . . . 0.0 110.093 175.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -64.71 -32.95 74.85 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.857 -0.527 . . . . 0.0 112.072 174.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -147.24 170.2 8.13 Favored Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 124.593 1.157 . . . . 0.0 112.228 -175.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -52.33 130.76 37.21 Favored 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 123.3 2.667 . . . . 0.0 111.612 174.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 28.4 mm -69.11 119.25 14.69 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 N-CA-C 106.819 -1.549 . . . . 0.0 106.819 174.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.1 mtpt -97.14 -17.35 19.97 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.851 -1.071 . . . . 0.0 110.78 174.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.434 HD21 HD13 ' A' ' 131' ' ' LEU . 59.5 tp -142.09 128.44 19.98 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 119.951 1.251 . . . . 0.0 110.412 -169.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 2.1 mp -137.82 113.56 9.71 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 107.936 -1.135 . . . . 0.0 107.936 -170.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.724 HG21 HD22 ' A' ' 118' ' ' LEU . 1.2 mp -100.16 111.56 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 175.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -78.7 147.79 31.33 Favored Glycine 0 CA--C 1.529 0.954 0 N-CA-C 110.065 -1.214 . . . . 0.0 110.065 173.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -139.34 141.05 37.66 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 171.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 28.5 p -131.33 142.34 50.07 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 127.58 2.352 . . . . 0.0 106.533 171.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -145.86 133.6 21.12 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -75.61 -22.17 57.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 122.818 0.447 . . . . 0.0 111.42 179.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -145.83 154.49 42.05 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 124.141 0.977 . . . . 0.0 109.77 178.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -59.04 -31.69 69.07 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 -177.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -77.61 -32.85 53.77 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 119.24 0.927 . . . . 0.0 111.373 178.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 4.4 m -60.95 -42.88 99.1 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 169.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -56.78 -48.83 77.01 Favored 'General case' 0 C--O 1.222 -0.344 0 C-N-CA 124.539 1.136 . . . . 0.0 110.51 171.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 6.0 mm -58.24 -45.56 88.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 C-N-CA 123.37 0.668 . . . . 0.0 110.57 -177.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -73.96 -33.64 57.09 Favored Glycine 0 CA--C 1.529 0.917 0 CA-C-N 119.715 1.143 . . . . 0.0 111.597 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.66 -46.96 80.23 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.122 0.969 . . . . 0.0 110.886 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.4 mm -54.39 -45.04 68.97 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.355 0 C-N-CA 125.076 1.35 . . . . 0.0 108.444 174.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -69.19 -9.96 55.43 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 118.297 -0.858 . . . . 0.0 112.807 -178.66 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -90.36 -38.43 13.34 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 119.796 1.18 . . . . 0.0 109.056 170.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.724 HD22 HG21 ' A' ' 101' ' ' ILE . 88.6 mt -72.76 -31.82 65.2 Favored 'General case' 0 CA--C 1.517 -0.321 0 O-C-N 121.759 -0.588 . . . . 0.0 111.055 -178.347 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 21.2 m -61.09 -20.91 63.17 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.495 0.718 . . . . 0.0 112.108 173.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -66.95 -25.19 66.22 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.656 1.116 . . . . 0.0 110.212 174.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 41.5 mt -103.04 -61.38 1.41 Allowed 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.132 0.973 . . . . 0.0 111.046 -176.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 15.6 mt -73.98 -1.22 18.94 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -172.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 37.1 m -114.91 26.47 10.13 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 119.6 1.091 . . . . 0.0 111.653 173.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -138.58 96.73 3.2 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 -172.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -58.23 -23.91 57.47 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.677 0.791 . . . . 0.0 112.501 -173.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -62.73 -49.59 74.43 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 121.323 0.582 . . . . 0.0 109.624 174.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.82 -40.37 83.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 C-N-CA 124.646 1.178 . . . . 0.0 109.51 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 31.9 mt -54.79 -43.49 72.91 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 118.574 -0.727 . . . . 0.0 111.18 -172.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -67.17 -38.15 84.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 118.693 0.679 . . . . 0.0 110.708 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . 0.423 ' HB3' HD11 ' A' ' 143' ' ' ILE . 62.1 mt-30 -70.17 -32.64 70.69 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.038 0.535 . . . . 0.0 110.098 -176.004 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.434 HD13 HD21 ' A' ' 99' ' ' LEU . 30.2 mt -72.78 -52.5 14.75 Favored 'General case' 0 C--O 1.223 -0.311 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 169.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 42.2 mt -58.59 -11.62 3.22 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.512 1.125 . . . . 0.0 113.746 -175.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 62.5 p -116.12 15.67 16.02 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.101 1.361 . . . . 0.0 110.797 179.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -57.44 95.41 0.02 OUTLIER 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.02 1.328 . . . . 0.0 110.73 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 50.7 m -82.39 -14.59 54.97 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 123.686 0.794 . . . . 0.0 111.099 -176.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 30.2 m -146.76 154.98 42.03 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 125.929 1.692 . . . . 0.0 106.728 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -54.88 -35.1 63.73 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.042 1.337 . . . . 0.0 111.687 178.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -53.22 -36.23 60.8 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 123.18 0.592 . . . . 0.0 111.988 176.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -64.79 -35.85 82.41 Favored 'General case' 0 N--CA 1.442 -0.849 0 C-N-CA 123.999 0.919 . . . . 0.0 112.426 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 59.3 mt -67.83 -44.12 77.95 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 175.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -75.08 -24.13 58.13 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -176.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -60.22 -44.45 95.16 Favored 'General case' 0 C--N 1.329 -0.325 0 O-C-N 120.736 -1.228 . . . . 0.0 109.658 171.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.423 HD11 ' HB3' ' A' ' 130' ' ' GLN . 96.6 mt -68.87 -35.53 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 C-N-CA 124.581 1.153 . . . . 0.0 109.792 -178.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . . . . . . . . . 16.9 mm -55.9 -49.78 72.91 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 122.958 0.503 . . . . 0.0 110.315 169.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 39.3 m -64.79 -27.19 68.72 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -168.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 18.3 mtt180 -69.56 -25.85 64.2 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 123.201 0.6 . . . . 0.0 111.596 175.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.865 0 C-N-CA 125.815 1.674 . . . . 0.0 111.449 -169.583 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.3 tpt . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 110.202 -0.295 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.6 mpt_? -66.1 109.28 2.54 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 168.782 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -54.02 -45.19 71.49 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.35 -19.22 5.08 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.913 1.685 . . . . 0.0 113.712 -178.032 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -66.64 -30.7 71.03 Favored 'General case' 0 C--N 1.342 0.251 0 CA-C-N 119.494 1.043 . . . . 0.0 111.967 176.621 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -86.56 -34.46 19.92 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.902 -0.571 . . . . 0.0 112.042 -174.137 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -90.08 104.47 8.7 Favored Pre-proline 0 N--CA 1.471 0.608 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 -173.491 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.05 -66.11 0.08 OUTLIER 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 122.935 2.423 . . . . 0.0 113.863 -169.368 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -167.49 -64.73 0.03 OUTLIER 'General case' 0 C--O 1.231 0.127 0 C-N-CA 125.49 1.516 . . . . 0.0 109.792 178.817 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 1.2 m -69.18 5.76 1.15 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.156 1.382 . . . . 0.0 112.26 177.159 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.44 -29.84 71.06 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 126.116 1.767 . . . . 0.0 111.216 -174.019 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 13.1 mm -91.23 134.96 28.16 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.323 0 C-N-CA 125.734 1.613 . . . . 0.0 107.109 -169.781 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.4 m -157.27 151.52 24.94 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.238 0.926 . . . . 0.0 111.223 170.717 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 76.5 t -122.62 143.55 35.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 169.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.8 mt -140.89 147.8 22.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 -170.023 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 69.0 t60 -73.55 -47.14 43.04 Favored 'General case' 0 CA--C 1.531 0.218 0 O-C-N 121.701 -0.624 . . . . 0.0 109.935 172.055 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.9 p -161.85 146.28 12.76 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 -177.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.93 158.81 29.2 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 169.807 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.97 -43.63 86.58 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.525 0.73 . . . . 0.0 109.956 174.787 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -167.78 178.03 5.46 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 128.377 2.671 . . . . 0.0 107.452 175.067 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -57.5 -35.6 70.44 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 126.021 1.729 . . . . 0.0 113.734 176.767 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.426 ' O ' ' HE2' ' A' ' 47' ' ' LYS . 33.4 mt-30 -62.32 -51.18 68.68 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 120.52 1.509 . . . . 0.0 108.308 171.772 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -59.83 -34.26 72.86 Favored 'General case' 0 C--O 1.222 -0.346 0 O-C-N 121.76 -0.587 . . . . 0.0 111.501 179.176 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.87 -32.67 74.49 Favored 'General case' 0 N--CA 1.452 -0.373 0 O-C-N 121.584 -0.698 . . . . 0.0 110.919 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -68.59 -45.82 81.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 172.113 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -56.72 -42.8 79.83 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 121.624 -0.673 . . . . 0.0 110.569 176.564 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 26.4 m-85 -70.31 -16.37 63.0 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.222 -0.924 . . . . 0.0 112.996 174.209 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 19.8 m -79.49 -19.11 50.51 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 120.088 1.313 . . . . 0.0 110.916 169.25 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 7.9 mmt -126.36 -17.42 5.16 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 116.075 1.88 . . . . 0.0 116.075 -168.615 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -59.67 -36.15 63.84 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 120.908 1.685 . . . . 0.0 112.03 -169.37 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.0 m -61.83 -26.81 68.35 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 118.839 0.745 . . . . 0.0 112.074 179.42 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 86.8 mt -86.25 -43.83 12.63 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.96 1.304 . . . . 0.0 108.62 177.012 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.7 tp -55.89 -41.93 75.19 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.79 0.836 . . . . 0.0 110.779 177.638 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -60.16 -30.2 69.17 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 126.199 1.8 . . . . 0.0 113.556 -174.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.9 mttm -111.54 20.05 17.55 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -177.262 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . 0.341 0.7 OUTLIER 47.47 35.99 4.69 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.403 1.881 . . . . 0.0 114.911 -176.022 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.408 ' CD2' ' HB2' ' A' ' 76' ' ' LYS . 49.6 m-85 -64.51 -22.18 66.89 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.258 -0.901 . . . . 0.0 110.112 168.574 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.7 pt -146.12 165.7 9.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 127.303 2.241 . . . . 0.0 107.569 -177.122 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.4 p -98.5 166.86 11.16 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.3 1.04 . . . . 0.0 108.864 169.292 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -60.72 -31.38 70.67 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.283 -0.886 . . . . 0.0 111.726 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.5 t30 -59.46 -32.86 70.62 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 122.935 0.494 . . . . 0.0 111.626 176.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -59.37 -45.97 89.95 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 122.964 0.505 . . . . 0.0 110.329 -179.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.406 ' H ' HD12 ' A' ' 43' ' ' ILE . 4.3 mp -60.01 -49.79 82.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 176.559 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -68.53 -27.24 65.92 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 118.27 -0.872 . . . . 0.0 112.082 -173.636 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.71 -45.0 90.53 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 119.417 1.008 . . . . 0.0 110.557 172.697 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 25.4 mt -68.52 -46.72 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 -178.493 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.426 ' HE2' ' O ' ' A' ' 22' ' ' GLN . 87.7 mttt -59.73 -47.69 84.64 Favored 'General case' 0 C--N 1.341 0.224 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 -177.432 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -62.13 -44.08 97.43 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 123.85 0.86 . . . . 0.0 110.846 -177.176 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.9 m -59.74 -48.71 80.59 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.463 0.705 . . . . 0.0 109.942 175.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 69.4 m -58.03 -43.49 86.8 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.141 0.976 . . . . 0.0 111.27 178.912 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 73.3 mt -65.89 -41.21 89.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 O-C-N 121.365 -0.834 . . . . 0.0 109.695 177.787 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -72.23 -37.76 69.1 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.475 0.917 . . . . 0.0 113.475 -172.179 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -141.76 11.08 2.04 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -167.542 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 78.67 170.49 37.86 Favored Glycine 0 CA--C 1.533 1.194 0 N-CA-C 110.701 -0.96 . . . . 0.0 110.701 -169.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -63.41 153.28 75.59 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 122.964 2.443 . . . . 0.0 111.159 -176.533 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -109.4 -8.54 15.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.66 0.784 . . . . 0.0 112.115 -174.287 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -136.0 77.06 1.64 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.243 1.017 . . . . 0.0 108.729 -169.607 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.8 mm -120.97 135.24 61.79 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 175.552 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -120.73 -31.44 4.25 Favored 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 122.965 0.506 . . . . 0.0 111.854 -169.517 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -161.82 164.01 18.46 Favored Pre-proline 0 C--O 1.236 0.368 0 C-N-CA 125.261 1.424 . . . . 0.0 107.532 -177.64 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_exo -45.9 115.2 0.98 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 123.306 2.671 . . . . 0.0 111.853 171.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.55 1.07 87.88 Favored Glycine 0 CA--C 1.533 1.168 0 CA-C-O 117.719 -1.601 . . . . 0.0 114.693 176.199 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 69.9 t -124.93 122.13 62.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 119.966 1.883 . . . . 0.0 108.572 -169.925 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -124.12 169.76 11.38 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 125.372 1.469 . . . . 0.0 109.643 176.373 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.59 ' HE2' HD12 ' A' ' 122' ' ' LEU . 4.8 ttm -139.95 59.92 14.26 Favored Pre-proline 0 CA--C 1.537 0.445 0 C-N-CA 123.761 0.824 . . . . 0.0 110.698 174.458 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -57.24 123.85 14.79 Favored 'Trans proline' 0 N--CA 1.453 -0.855 0 C-N-CA 121.232 1.288 . . . . 0.0 109.83 -174.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.3 p-80 -167.08 172.46 10.05 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 128.129 2.572 . . . . 0.0 108.454 174.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -132.94 171.09 14.42 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.079 1.352 . . . . 0.0 110.24 -174.27 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -57.03 155.36 16.17 Favored Pre-proline 0 N--CA 1.472 0.632 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.602 173.082 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -61.26 -35.67 83.63 Favored 'Trans proline' 0 CA--C 1.537 0.649 0 C-N-CA 121.57 1.513 . . . . 0.0 109.361 -176.784 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -67.65 -12.72 61.09 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.971 1.309 . . . . 0.0 112.437 -176.338 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 71.0 m -79.96 -3.3 47.68 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.755 0.707 . . . . 0.0 111.669 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 130.55 19.99 1.28 Allowed Glycine 0 C--N 1.337 0.626 0 CA-C-O 118.33 -1.261 . . . . 0.0 113.343 175.324 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.09 146.12 52.85 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 119.792 1.796 . . . . 0.0 109.041 169.882 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.1 mt -133.71 -28.93 1.37 Allowed 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 124.776 1.23 . . . . 0.0 111.045 -173.659 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.408 ' HB2' ' CD2' ' A' ' 37' ' ' TYR . 87.5 mttt -139.91 174.0 10.95 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.226 1.81 . . . . 0.0 107.749 172.904 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 95.1 m -105.92 126.44 52.18 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.353 1.061 . . . . 0.0 110.613 176.128 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.99 -176.14 41.33 Favored Glycine 0 CA--C 1.539 1.551 0 C-N-CA 125.865 1.698 . . . . 0.0 111.661 -177.597 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 42.1 mtt -146.66 171.3 15.32 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.762 1.625 . . . . 0.0 111.902 -176.77 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.6 m -136.4 161.72 35.05 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.56 1.944 . . . . 0.0 108.469 174.546 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.484 HD22 HD11 ' A' ' 144' ' ' ILE . 30.5 tp -142.52 103.18 4.2 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 125.21 1.404 . . . . 0.0 108.137 178.508 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 89.7 m -121.76 138.53 54.33 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.97 0.908 . . . . 0.0 108.732 -171.577 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.422 HD23 ' N ' ' A' ' 84' ' ' LEU . 5.1 tt -134.33 133.28 40.51 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 124.214 1.005 . . . . 0.0 108.412 179.095 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.422 ' N ' HD23 ' A' ' 83' ' ' LEU . 8.7 mp -113.51 122.14 46.37 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 126.16 1.784 . . . . 0.0 107.122 179.554 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -60.56 -40.97 93.58 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 118.931 0.787 . . . . 0.0 111.738 -178.727 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 39.2 mm-40 -87.54 -20.95 25.75 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 124.371 1.068 . . . . 0.0 111.414 179.923 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 67.5 -177.61 21.0 Favored Glycine 0 CA--C 1.529 0.958 0 N-CA-C 110.591 -1.003 . . . . 0.0 110.591 -168.708 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -148.56 167.54 3.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 N-CA-C 106.643 -1.614 . . . . 0.0 106.643 169.241 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -120.03 95.99 4.98 Favored 'General case' 0 C--O 1.231 0.112 0 O-C-N 121.756 -0.59 . . . . 0.0 110.205 -169.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 26.1 m-85 -50.2 137.85 20.84 Favored Pre-proline 0 CA--C 1.539 0.527 0 C-N-CA 123.163 0.585 . . . . 0.0 110.392 170.834 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -59.75 130.12 33.73 Favored 'Trans proline' 0 N--CA 1.455 -0.758 0 C-N-CA 122.89 2.393 . . . . 0.0 110.761 -174.316 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 67.89 9.1 55.7 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 118.158 -1.356 . . . . 0.0 114.665 173.157 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -72.0 168.88 17.11 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 120.169 1.985 . . . . 0.0 109.833 171.877 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -66.12 -38.68 88.77 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.488 -0.757 . . . . 0.0 111.675 176.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -155.64 167.66 13.77 Favored Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.546 1.138 . . . . 0.0 111.893 -172.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.98 159.7 47.42 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.917 2.411 . . . . 0.0 111.999 178.186 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 36.3 mm -112.99 139.27 39.02 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.357 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 -178.266 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt -116.94 -7.73 11.36 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-O 117.835 -1.079 . . . . 0.0 110.743 175.644 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.446 HD21 HD13 ' A' ' 131' ' ' LEU . 15.4 tp -145.1 134.08 22.55 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 120.161 1.346 . . . . 0.0 110.712 -176.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.2 mp -138.52 111.6 7.9 Favored 'General case' 0 C--O 1.233 0.213 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 -169.769 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 1.8 mp -92.84 114.79 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 106.783 -1.562 . . . . 0.0 106.783 172.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -74.16 154.02 47.37 Favored Glycine 0 CA--C 1.526 0.77 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 170.002 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.521 HD23 ' N ' ' A' ' 104' ' ' SER . 0.8 OUTLIER -143.77 150.4 38.51 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 103.821 -2.659 . . . . 0.0 103.821 169.741 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.521 ' N ' HD23 ' A' ' 103' ' ' LEU . 27.0 p -144.5 142.29 30.14 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 168.815 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . 0.578 ' HB3' ' CD2' ' A' ' 111' ' ' HIS . . . -150.59 132.75 15.35 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 119.395 0.998 . . . . 0.0 108.505 -179.653 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -76.28 -19.85 57.9 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.818 -174.176 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -140.48 154.59 46.65 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.888 0.875 . . . . 0.0 110.352 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -58.82 -37.46 76.45 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 -178.161 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -71.85 -30.22 65.22 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.966 -1.083 . . . . 0.0 110.83 176.43 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.3 m -65.87 -36.42 83.38 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.437 169.835 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' HIS . . . . . 0.578 ' CD2' ' HB3' ' A' ' 105' ' ' ALA . 49.9 m-70 -59.82 -48.87 79.94 Favored 'General case' 0 C--N 1.346 0.447 0 CA-C-N 119.858 1.208 . . . . 0.0 109.476 170.857 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 24.3 mm -55.34 -54.65 22.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-N 118.703 0.683 . . . . 0.0 109.35 179.518 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -61.29 -39.25 96.95 Favored Glycine 0 CA--C 1.53 0.997 0 CA-C-N 118.888 0.767 . . . . 0.0 111.692 -176.183 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.428 ' CB ' HD21 ' A' ' 103' ' ' LEU . . . -65.67 -54.97 20.28 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 123.912 0.885 . . . . 0.0 110.373 179.007 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 8.6 mm -51.6 -48.24 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.709 0 C-N-CA 125.901 1.68 . . . . 0.0 108.424 177.037 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -66.79 -18.01 65.16 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.503 -0.748 . . . . 0.0 111.876 -176.524 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' ALA . . . . . . . . . . . . . . . -85.86 -48.4 8.79 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 123.691 0.796 . . . . 0.0 109.369 173.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.426 HD21 HD12 ' A' ' 103' ' ' LEU . 3.2 pp -67.57 -23.56 65.42 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 118.24 0.473 . . . . 0.0 112.131 -178.986 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.426 ' N ' HD12 ' A' ' 118' ' ' LEU . 60.2 m -62.95 -22.91 67.13 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 123.863 0.865 . . . . 0.0 111.726 174.056 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -66.17 -17.46 64.74 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.945 0.793 . . . . 0.0 110.035 173.505 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 34.8 mt -108.62 -60.94 1.67 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.009 1.324 . . . . 0.0 110.119 179.456 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.59 HD12 ' HE2' ' A' ' 65' ' ' MET . 9.9 mt -62.77 -21.03 65.55 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.877 1.436 . . . . 0.0 114.877 -175.604 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 38.1 m -111.13 26.15 11.0 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 118.945 0.793 . . . . 0.0 110.826 -179.201 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -132.51 97.38 4.07 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.064 1.346 . . . . 0.0 107.74 178.409 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -56.06 -27.8 54.92 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.691 0.797 . . . . 0.0 112.456 -177.128 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -65.12 -44.55 88.34 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 123.163 0.585 . . . . 0.0 110.02 176.584 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 1.4 mp -66.92 -43.31 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 174.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.474 HD21 ' HA ' ' A' ' 122' ' ' LEU . 55.8 mt -55.66 -43.5 76.35 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 118.58 0.627 . . . . 0.0 111.128 -174.532 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -67.37 -38.85 85.41 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 122.775 0.43 . . . . 0.0 110.614 178.797 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -70.03 -33.23 71.72 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 118.663 0.665 . . . . 0.0 109.91 -176.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.446 HD13 HD21 ' A' ' 99' ' ' LEU . 32.4 mt -68.3 -56.31 9.05 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 107.863 -1.162 . . . . 0.0 107.863 169.834 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' LEU . . . . . . . . . . . . . 40.3 mt -57.64 -12.12 2.63 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 114.252 1.204 . . . . 0.0 114.252 -174.395 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' THR . . . . . . . . . . . . . 50.9 p -114.11 7.45 16.69 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.067 1.347 . . . . 0.0 111.433 179.358 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -59.48 110.86 1.2 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.499 1.519 . . . . 0.0 110.235 175.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 6.6 m -68.25 -28.02 66.85 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.099 0.559 . . . . 0.0 111.838 176.846 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 136' ' ' SER . . . . . . . . . . . . . 19.2 m -149.54 160.53 43.4 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.056 1.343 . . . . 0.0 108.917 -172.183 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 57.2 mp0 -54.24 -34.47 60.79 Favored 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.119 1.367 . . . . 0.0 111.408 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -53.22 -38.27 62.77 Favored 'General case' 0 N--CA 1.461 0.117 0 C-N-CA 123.119 0.568 . . . . 0.0 112.442 -179.893 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 21.5 tp60 -80.75 -27.7 36.72 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 119.024 0.829 . . . . 0.0 110.605 -178.234 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 42.9 mt -65.48 -50.5 65.11 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.434 1.015 . . . . 0.0 108.303 171.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.72 -33.94 73.66 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.123 0.969 . . . . 0.0 112.679 176.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -59.83 -43.45 94.56 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 118.955 0.798 . . . . 0.0 110.677 175.185 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 77.4 mt -70.5 -35.12 60.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 123.166 0.586 . . . . 0.0 109.716 -178.57 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 144' ' ' ILE . . . . . 0.484 HD11 HD22 ' A' ' 81' ' ' LEU . 22.3 mm -57.17 -52.37 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.386 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 169.469 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 21.4 m -65.1 -27.83 69.03 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.279 -170.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 7.7 ttm180 -59.3 -24.55 63.39 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.275 1.83 . . . . 0.0 113.601 174.565 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 147' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.931 0 N-CA-C 108.942 -1.663 . . . . 0.0 108.942 -176.966 . . . . . . . . 0 0 . 1 stop_ save_